TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T16739 Lysine-specific histone demethylase 1 D0E7PQ Vorinostat Approved 5311 C14H20N2O3 264.32 C1=CC=C(C=C1)NC(=O)CCCCCCC(=O)NO IC50 ~ 100000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B09JNS [1-[(4-Methylphenyl)methyl]triazol-4-yl]methyl 4-methylpiperazine-1-carbodithioate Investigative 72713759 C17H23N5S2 361.5 CC1=CC=C(C=C1)CN2C=C(N=N2)CSC(=S)N3CCN(CC3)C IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B0GE4R 4-Phenyl-2-prop-2-ynylsulfanyl-6-[3-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile Investigative 118713037 C21H13F3N4S 410.4 C#CCSC1=NC(=C(C(=N1)NC2=CC=CC(=C2)C(F)(F)F)C#N)C3=CC=CC=C3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B0JYM4 [1-[(2-Chlorophenyl)methyl]triazol-4-yl]methyl piperazine-1-carbodithioate Investigative 71652980 C15H18ClN5S2 367.9 C1CN(CCN1)C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3Cl IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B0RZQ6 [1-[(4-Methylphenyl)methyl]triazol-4-yl]methyl morpholine-4-carbodithioate Investigative 72713113 C16H20N4OS2 348.5 CC1=CC=C(C=C1)CN2C=C(N=N2)CSC(=S)N3CCOCC3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B0VX3J Tert-butyl 4-[[1-(4-methylphenyl)triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71653425 C20H27N5O2S2 433.6 CC1=CC=C(C=C1)N2C=C(N=N2)CSC(=S)N3CCN(CC3)C(=O)OC(C)(C)C IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B10NSQ 1-(4-Acetyl-1,3-thiazol-2-yl)-3-phenylurea Investigative 64545027 C12H11N3O2S 261.3 CC(=O)C1=CSC(=N1)NC(=O)NC2=CC=CC=C2 IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B1A9JW [1-[(3,4,5-Trimethoxyphenyl)methyl]triazol-4-yl]methyl piperazine-1-carbodithioate Investigative 71653123 C18H25N5O3S2 423.6 COC1=CC(=CC(=C1OC)OC)CN2C=C(N=N2)CSC(=S)N3CCNCC3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B1GTV2 N-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]methanesulfonamide Investigative 76314915 C10H9ClN2O2S2 288.8 CS(=O)(=O)NC1=NC(=CS1)C2=CC=C(C=C2)Cl IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B1RNJ0 [1-[(4-Fluorophenyl)methyl]triazol-4-yl]methyl morpholine-4-carbodithioate Investigative 72714195 C15H17FN4OS2 352.5 C1COCCN1C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B1WOD6 Oc1ccc(Cl)cc1Nc1nc2cc(ccc2[nH]1)S(=O)(=O)N1CCOCC1 Investigative 117926025 C17H17ClN4O4S 408.9 C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)NC4=C(C=CC(=C4)Cl)O IC50 = 90000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B1Y0VS Benzyl 4-[[1-[(2-chlorophenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71653126 C23H24ClN5O2S2 502.1 C1CN(CCN1C(=O)OCC2=CC=CC=C2)C(=S)SCC3=CN(N=N3)CC4=CC=CC=C4Cl IC50 = 53200 nM Poor binder T16739 Lysine-specific histone demethylase 1 B1YH7D N-(4-Acetyl-1,3-thiazol-2-yl)benzamide Investigative 24632452 C12H10N2O2S 246.29 CC(=O)C1=CSC(=N1)NC(=O)C2=CC=CC=C2 IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B26SVY Tert-butyl 4-[[1-(naphthalen-2-ylmethyl)triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713538 C24H29N5O2S2 483.7 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC4=CC=CC=C4C=C3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B2KGF6 Tert-butyl 4-[[1-[(2-methylphenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713116 C21H29N5O2S2 447.6 CC1=CC=CC=C1CN2C=C(N=N2)CSC(=S)N3CCN(CC3)C(=O)OC(C)(C)C IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B2KY3P 1-[2-(3-Chloroanilino)-1,3-thiazol-4-yl]ethanone Investigative 76333040 C11H9ClN2OS 252.72 CC(=O)C1=CSC(=N1)NC2=CC(=CC=C2)Cl IC50 = 123000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B2NXU0 1-[2-(4-Chloroanilino)-1,3-thiazol-4-yl]ethanone Investigative 2744807 C11H9ClN2OS 252.72 CC(=O)C1=CSC(=N1)NC2=CC=C(C=C2)Cl IC50 = 121000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B2OM0B Tert-butyl 4-[[1-[(4-hydroxyphenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713319 C20H27N5O3S2 449.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)O IC50 = 70700 nM Poor binder T16739 Lysine-specific histone demethylase 1 B38BWP [1-[(2,6-Difluorophenyl)methyl]triazol-4-yl]methyl piperazine-1-carbodithioate Investigative 71760961 C15H17F2N5S2 369.5 C1CN(CCN1)C(=S)SCC2=CN(N=N2)CC3=C(C=CC=C3F)F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B39LYE 4-(4-Nitroanilino)-6-phenyl-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 118733311 C20H13N5O2S 387.4 C#CCSC1=NC(=C(C(=N1)NC2=CC=C(C=C2)[N+](=O)[O-])C#N)C3=CC=CC=C3 IC50 = 123310.48 nM Poor binder T16739 Lysine-specific histone demethylase 1 B3D5SA (2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-6-Amino-1-[(2S)-2-[[(2S)-1-amino-6-[(2-hydroxyacetyl)amino]-1-oxohexan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxohexan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-(2-hydroxyacetyl)pyrrolidine-2-carboxamide Investigative 134131047 C61H103N19O15 1342.6 CC(C)C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCNC(=O)CO)C(=O)N)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]3CCCN3C(=O)CO Ki = 190000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B3TQN7 4-(3-Chloroanilino)-6-phenyl-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 118713040 C20H13ClN4S 376.9 C#CCSC1=NC(=C(C(=N1)NC2=CC(=CC=C2)Cl)C#N)C3=CC=CC=C3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B3V5HS N-Cyclopropyl-4-[2-(4-methylphenyl)-5-(piperidin-4-ylmethoxy)pyridin-3-yl]benzamide Investigative 127028982 C28H31N3O2 441.6 CC1=CC=C(C=C1)C2=C(C=C(C=N2)OCC3CCNCC3)C4=CC=C(C=C4)C(=O)NC5CC5 Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B3W8VA 4-(Tert-Butoxycarbonyl)piperazine-1-dithiocarboxylic acid 1-(7-hydroxycoumarin-3-ylmethyl)-1H-1,2,3-triazole-4-ylmethyl ester Investigative 73055636 C23H27N5O5S2 517.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC4=C(C=C(C=C4)O)OC3=O IC50 = 102560 nM Poor binder T16739 Lysine-specific histone demethylase 1 B48UWN N-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]-1-phenylmethanesulfonamide Investigative 76333044 C16H13ClN2O2S2 364.9 C1=CC=C(C=C1)CS(=O)(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Cl IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B49AQR [1-[(4-Methylphenyl)methyl]triazol-4-yl]methyl 4-(2-hydroxyethyl)piperazine-1-carbodithioate Investigative 72713972 C18H25N5OS2 391.6 CC1=CC=C(C=C1)CN2C=C(N=N2)CSC(=S)N3CCN(CC3)CCO IC50 = 83400 nM Poor binder T16739 Lysine-specific histone demethylase 1 B4FX9P Tert-butyl 4-[[1-[[2-(trifluoromethyl)phenyl]methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71616470 C21H26F3N5O2S2 501.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3C(F)(F)F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B4HO5V 1-[2-(3-Hydroxyanilino)-1,3-thiazol-4-yl]ethanone Investigative 76318528 C11H10N2O2S 234.28 CC(=O)C1=CSC(=N1)NC2=CC(=CC=C2)O IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B4LIR8 [1-[(4-Methylphenyl)methyl]triazol-4-yl]methyl 4-ethylpiperazine-1-carbodithioate Investigative 72713762 C18H25N5S2 375.6 CCN1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)C IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B4PWG9 [1-[[4-(Trifluoromethyl)phenyl]methyl]triazol-4-yl]methyl piperazine-1-carbodithioate Investigative 72713325 C16H18F3N5S2 401.5 C1CN(CCN1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)C(F)(F)F IC50 = 87400 nM Poor binder T16739 Lysine-specific histone demethylase 1 B54INS 4-(4-Bromophenyl)-6-(4-chloroanilino)-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 118733315 C20H12BrClN4S 455.8 C#CCSC1=NC(=C(C(=N1)NC2=CC=C(C=C2)Cl)C#N)C3=CC=C(C=C3)Br IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B54QJD (1R,2S)-2-(2-Phenylphenyl)cyclopropan-1-amine;hydrochloride Investigative 56666983 C15H16ClN 245.74 C1[C@H]([C@@H]1N)C2=CC=CC=C2C3=CC=CC=C3.Cl Ki ~ 100000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B58VSJ 4-Chloro-6-(4-chlorophenyl)-2-[[1-[(2-chlorophenyl)methyl]triazol-4-yl]methylsulfanyl]pyrimidine-5-carbonitrile Investigative 118733320 C21H13Cl3N6S 487.8 C1=CC=C(C(=C1)CN2C=C(N=N2)CSC3=NC(=C(C(=N3)Cl)C#N)C4=CC=C(C=C4)Cl)Cl IC50 = 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B5B8QT (2S)-2-[[(2S)-6-Amino-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[2-[[2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-5-carbamimidamido-2-[(2-hydroxyacetyl)amino]pentanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylsulfanylbutanoyl]amino]-5-oxopentanoyl]amino]-3-hydroxybutanoyl]amino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]hexanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]acetyl]amino]hexanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]amino]hexanoyl]amino]-N-[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]pentanediamide Investigative 137645494 C89H162N34O27S 2172.5 C[C@H]([C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCSC)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CO)O Ki = 170000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B5BMG4 [1-[(2-Chlorophenyl)methyl]triazol-4-yl]methyl 4-methylpiperazine-1-carbodithioate Investigative 72713761 C16H20ClN5S2 381.9 CN1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3Cl IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B5EZ3N Tert-butyl 4-[[1-(2-oxochromen-4-yl)triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713542 C22H25N5O4S2 487.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)C3=CC(=O)OC4=CC=CC=C43 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B5F1BI 3-Chloro-N-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]benzenesulfonamide Investigative 76329400 C15H10ClN3O4S2 395.8 C1=CC=C(C(=C1)C2=CSC(=N2)NS(=O)(=O)C3=CC(=CC=C3)Cl)[N+](=O)[O-] IC50 = 61600 nM Poor binder T16739 Lysine-specific histone demethylase 1 B5NO1G [1-[(2-Fluorophenyl)methyl]triazol-4-yl]methyl 4-ethylpiperazine-1-carbodithioate Investigative 72713763 C17H22FN5S2 379.5 CCN1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B5SFY6 Tert-butyl 4-[[1-[(2,4-dihydroxyphenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713322 C20H27N5O4S2 465.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=C(C=C(C=C3)O)O IC50 = 81300 nM Poor binder T16739 Lysine-specific histone demethylase 1 B63DQM 2-(4-Methylphenyl)-5-(piperidin-4-ylmethoxy)-3-[4-(piperidin-1-ylmethyl)phenyl]pyridine Investigative 127024904 C30H37N3O 455.6 CC1=CC=C(C=C1)C2=C(C=C(C=N2)OCC3CCNCC3)C4=CC=C(C=C4)CN5CCCCC5 Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B64SIV [1-[(2-Fluorophenyl)methyl]triazol-4-yl]methyl 4-methylpiperazine-1-carbodithioate Investigative 72713758 C16H20FN5S2 365.5 CN1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B6GK8X [1-[(4-Fluorophenyl)methyl]triazol-4-yl]methyl 4-(2-hydroxyethyl)piperazine-1-carbodithioate Investigative 72713974 C17H22FN5OS2 395.5 C1CN(CCN1CCO)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B6L4XW Tert-butyl 4-[[1-[(5-oxo-2H-furan-3-yl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713541 C18H25N5O4S2 439.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC(=O)OC3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B6N9FX [1-[(2-Fluorophenyl)methyl]triazol-4-yl]methyl morpholine-4-carbodithioate Investigative 72714194 C15H17FN4OS2 352.5 C1COCCN1C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B6U2CB 4-(Tert-Butoxycarbonyl)piperazine-1-dithiocarboxylic acid 1-(coumarin-3-ylmethyl)-1H-1,2,3-triazole-4-ylmethyl ester Investigative 76336591 C23H27N5O4S2 501.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC4=CC=CC=C4OC3=O IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B6X5UY 4-(4-Chloroanilino)-6-phenyl-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 118713039 C20H13ClN4S 376.9 C#CCSC1=NC(=C(C(=N1)NC2=CC=C(C=C2)Cl)C#N)C3=CC=CC=C3 IC50 = 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B76LVC 4'-(Methoxycarbonyl)-[2,2'-bipyridine]-4-carboxylic acid Investigative 25138011 C13H10N2O4 258.23 COC(=O)C1=CC(=NC=C1)C2=NC=CC(=C2)C(=O)O IC50 ~ 100000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B7FUC2 N-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]-N,4-dimethylbenzenesulfonamide Investigative 76318531 C17H15ClN2O2S2 378.9 CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=NC(=CS2)C3=CC=C(C=C3)Cl IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B7IB0U (2S)-2-[[(2S)-2-[[(2S)-5-Amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[2-[[2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2R)-2-aminopropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]amino]-5-oxopentanoyl]amino]-3-hydroxybutanoyl]amino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-6-(2,5-dihydropyrrol-1-yl)hexanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]acetyl]amino]hexanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]amino]hexanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]propanoic acid Investigative 118728857 C98H176N36O28 2306.7 C[C@@H]([C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN1CC=CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@H](C)O)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H]([C@H](C)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)N)O IC50 ~ 100000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B7JRV8 Chembl4299336 Investigative 145948688 C111H180N36O29 2482.8 CC(C)C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@H](CO)C(=O)N[C@H](CC(=O)O)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(=O)N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](CCCCN)C(=O)N3CCC[C@@H]3C(=O)N[C@@H](CC(=O)N)C(=O)N[C@H](CC4=CC=C(C=C4)O)C(=O)N[C@H](CO)C(=O)N[C@H](CCC(=O)N)C(=O)N)NC(=O)[C@H](CCCCN[C@H]5C[C@@H]5C6=CC=CC=C6)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]7CCCN7 IC50 = 63000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B7O5MW Parnate Investigative 19493 C9H11N 133.19 C1[C@H]([C@@H]1N)C2=CC=CC=C2 IC50 = 80700 nM Poor binder T16739 Lysine-specific histone demethylase 1 B7UQJ6 [1-[(4-Fluorophenyl)methyl]triazol-4-yl]methyl piperidine-1-carbodithioate Investigative 72714189 C16H19FN4S2 350.5 C1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B8DG6J 2-Prop-2-ynylsulfanyl-4-[3-(trifluoromethyl)anilino]-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile Investigative 118733317 C24H19F3N4O3S 500.5 COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=N2)SCC#C)NC3=CC=CC(=C3)C(F)(F)F)C#N IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B8GC5L 1-(6-Bromonaphthalen-2-yl)oxy-3-(cyclopropylamino)propan-2-ol Investigative 43343228 C16H18BrNO2 336.22 C1CC1NCC(COC2=CC3=C(C=C2)C=C(C=C3)Br)O IC50 = 111400 nM Poor binder T16739 Lysine-specific histone demethylase 1 B8GL1F [4-[2-(4-Methylphenyl)-5-(piperidin-4-ylmethoxy)pyridin-3-yl]phenyl]-piperazin-1-ylmethanone Investigative 127024902 C29H34N4O2 470.6 CC1=CC=C(C=C1)C2=C(C=C(C=N2)OCC3CCNCC3)C4=CC=C(C=C4)C(=O)N5CCNCC5 Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B8MF1B [4-[2-(4-Methylphenyl)-5-(piperidin-4-ylmethoxy)pyridin-3-yl]phenyl]methanol Investigative 127026390 C25H28N2O2 388.5 CC1=CC=C(C=C1)C2=C(C=C(C=N2)OCC3CCNCC3)C4=CC=C(C=C4)CO Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B8N2WX N-[3-[3-(Prop-2-ynylamino)propoxy]phenyl]benzamide Investigative 73334584 C19H20N2O2 308.4 C#CCNCCCOC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2 IC50 = 184200 nM Poor binder T16739 Lysine-specific histone demethylase 1 B8PC4G N-(4-Fluorophenyl)-2-[[(1S,2R)-2-phenylcyclopropyl]amino]acetamide Investigative 90654144 C17H17FN2O 284.33 C1[C@@H]([C@H]1NCC(=O)NC2=CC=C(C=C2)F)C3=CC=CC=C3 Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B8T3LF Benzyl 4-[[1-[(4-chlorophenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71653266 C23H24ClN5O2S2 502.1 C1CN(CCN1C(=O)OCC2=CC=CC=C2)C(=S)SCC3=CN(N=N3)CC4=CC=C(C=C4)Cl IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B8Y4NS N-[1-(4-Chlorophenyl)pyrazol-3-yl]-3-(trifluoromethyl)benzenesulfonamide Investigative 76333049 C16H11ClF3N3O2S 401.8 C1=CC(=CC(=C1)S(=O)(=O)NC2=NN(C=C2)C3=CC=C(C=C3)Cl)C(F)(F)F IC50 = 56900 nM Poor binder T16739 Lysine-specific histone demethylase 1 B92TIE (1-Benzyltriazol-4-yl)methyl piperidine-1-carbodithioate Investigative 72714191 C16H20N4S2 332.5 C1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B93IMX Tert-butyl 4-[[1-(4-methoxyphenyl)triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71653427 C20H27N5O3S2 449.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)C3=CC=C(C=C3)OC IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B96RZM N-(4-Acetyl-1,3-thiazol-2-yl)benzenesulfonamide Investigative 62999067 C11H10N2O3S2 282.3 CC(=O)C1=CSC(=N1)NS(=O)(=O)C2=CC=CC=C2 IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B9CK4T (1S,2R)-2-(4-Ethoxyphenyl)-2-fluorocyclopropan-1-amine Investigative 137644507 C11H14FNO 195.23 CCOC1=CC=C(C=C1)[C@@]2(C[C@@H]2N)F IC50 ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B9IMF3 4-Chloro-2-(prop-2-yn-1-ylthio)-6-(p-tolyl)pyrimidine-5-carbonitrile Investigative 87057358 C15H10ClN3S 299.8 CC1=CC=C(C=C1)C2=C(C(=NC(=N2)SCC#C)Cl)C#N IC50 = 59160 nM Poor binder T16739 Lysine-specific histone demethylase 1 B9J8XR (1S,2R)-2-Fluoro-2-(3-methoxyphenyl)cyclopropan-1-amine Investigative 137650930 C10H12FNO 181.21 COC1=CC=CC(=C1)[C@@]2(C[C@@H]2N)F IC50 ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B9RSC2 4-(Tert-Butoxycarbonyl)piperazine-1-dithiocarboxylic acid 1-(5-methyl-7-hydroxycoumarin-4-ylmethyl)-1H-1,2,3-triazole-4-ylmethyl ester Investigative 76329344 C24H29N5O5S2 531.7 CC1=CC(=CC2=C1C(=CC(=O)O2)CN3C=C(N=N3)CSC(=S)N4CCN(CC4)C(=O)OC(C)(C)C)O IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B9T4OG 4-Chloro-6-(4-nitrophenyl)-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 87057359 C14H7ClN4O2S 330.7 C#CCSC1=NC(=C(C(=N1)Cl)C#N)C2=CC=C(C=C2)[N+](=O)[O-] IC50 = 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B9VCW8 4-(Tert-Butoxycarbonyl)piperazine-1-dithiocarboxylic acid 1-(6-chlorocoumarin-4-ylmethyl)-1H-1,2,3-triazole-4-ylmethyl ester Investigative 76336592 C23H26ClN5O4S2 536.1 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC(=O)OC4=C3C=C(C=C4)Cl IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 B9VMC1 Ethyl (1S,2S)-1-amino-2-phenylcyclopropane-1-carboxylate Investigative 12106307 C12H15NO2 205.25 CCOC(=O)[C@@]1(C[C@H]1C2=CC=CC=C2)N IC50 ~ 100000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BA36ZV 3-Chloro-6-nitro-2-(trifluoromethyl)chromone Investigative 715694 C10H3ClF3NO4 293.58 C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=C(O2)C(F)(F)F)Cl IC50 = 51000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BA6IE1 Tert-butyl 4-[[1-[2-(4-methylphenyl)ethyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713323 C22H31N5O2S2 461.6 CC1=CC=C(C=C1)CCN2C=C(N=N2)CSC(=S)N3CCN(CC3)C(=O)OC(C)(C)C IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BACP51 4-(2-Chloroanilino)-6-phenyl-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 118713038 C20H13ClN4S 376.9 C#CCSC1=NC(=C(C(=N1)NC2=CC=CC=C2Cl)C#N)C3=CC=CC=C3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BAI4W5 (1S,2R)-2-Fluoro-2-(3-nitrophenyl)cyclopropan-1-amine Investigative 137657965 C9H9FN2O2 196.18 C1[C@@H]([C@@]1(C2=CC(=CC=C2)[N+](=O)[O-])F)N IC50 ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BAN96J 2-[Benzyl-[(1S,2R)-2-phenylcyclopropyl]amino]-N-tert-butylacetamide Investigative 90654151 C22H28N2O 336.5 CC(C)(C)NC(=O)CN(CC1=CC=CC=C1)[C@H]2C[C@@H]2C3=CC=CC=C3 Ki ~ 100000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BAO6K7 (1S,2R)-2-Phenylcyclopropan-1-amine;(1R,2S)-2-phenylcyclopropan-1-amine Investigative 73417116 C18H22N2 266.4 C1[C@H]([C@@H]1N)C2=CC=CC=C2.C1[C@@H]([C@H]1N)C2=CC=CC=C2 IC50 ~ 100000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BB18UF N-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]benzenesulfonamide Investigative 76333043 C15H11ClN2O2S2 350.8 C1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Cl IC50 = 85700 nM Poor binder T16739 Lysine-specific histone demethylase 1 BB6K2V [1-[(2-Fluorophenyl)methyl]triazol-4-yl]methyl 4-(2-hydroxyethyl)piperazine-1-carbodithioate Investigative 72713973 C17H22FN5OS2 395.5 C1CN(CCN1CCO)C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3F IC50 = 100100 nM Poor binder T16739 Lysine-specific histone demethylase 1 BB74WU Tert-butyl 4-[[1-[(3-hydroxyphenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713321 C20H27N5O3S2 449.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC(=CC=C3)O IC50 = 77100 nM Poor binder T16739 Lysine-specific histone demethylase 1 BBR0K9 (1S,2R)-2-Fluoro-2-[3-(pentafluoro-lambda6-sulfanyl)phenyl]cyclopropan-1-amine Investigative 137644883 C9H9F6NS 277.23 C1[C@@H]([C@@]1(C2=CC(=CC=C2)S(F)(F)(F)(F)F)F)N IC50 ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BC30HT [[5-Cyano-2-[(4-fluorophenyl)methylsulfanyl]-6-(3,4,5-trimethoxyphenyl)pyrimidin-4-yl]amino]thiourea Investigative 118733322 C22H21FN6O3S2 500.6 COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=N2)SCC3=CC=C(C=C3)F)NNC(=S)N)C#N IC50 = 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BCY8J1 (1R,2S)-2-(4-Fluorophenyl)cyclopropanamine Hydrochloride Investigative 56666982 C9H11ClFN 187.64 C1[C@H]([C@@H]1N)C2=CC=C(C=C2)F.Cl Ki = 79600 nM Poor binder T16739 Lysine-specific histone demethylase 1 BDM18K 1-[2-(4-Hydroxyanilino)-1,3-thiazol-4-yl]ethanone Investigative 76322188 C11H10N2O2S 234.28 CC(=O)C1=CSC(=N1)NC2=CC=C(C=C2)O IC50 = 57000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BDUW63 4-Chloro-2-[[1-[(2-chlorophenyl)methyl]triazol-4-yl]methylsulfanyl]-6-phenylpyrimidine-5-carbonitrile Investigative 118733319 C21H14Cl2N6S 453.3 C1=CC=C(C=C1)C2=C(C(=NC(=N2)SCC3=CN(N=N3)CC4=CC=CC=C4Cl)Cl)C#N IC50 = 97274.72 nM Poor binder T16739 Lysine-specific histone demethylase 1 BDXM80 N-[3-[3-[Methyl(prop-2-ynyl)amino]propoxy]phenyl]benzamide Investigative 73334585 C20H22N2O2 322.4 CN(CCCOC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2)CC#C IC50 = 93100 nM Poor binder T16739 Lysine-specific histone demethylase 1 BE58CV 4-[5-Hydroxy-2-(4-methylphenyl)pyridin-3-yl]benzonitrile Investigative 127025220 C19H14N2O 286.3 CC1=CC=C(C=C1)C2=C(C=C(C=N2)O)C3=CC=C(C=C3)C#N Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BEAY71 Tert-butyl 4-[[1-[(6-methyl-2-oxochromen-4-yl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 76318471 C24H29N5O4S2 515.7 CC1=CC2=C(C=C1)OC(=O)C=C2CN3C=C(N=N3)CSC(=S)N4CCN(CC4)C(=O)OC(C)(C)C IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BEM06J [1-[(3,4-Dichlorophenyl)methyl]triazol-4-yl]methyl piperazine-1-carbodithioate Investigative 71653122 C15H17Cl2N5S2 402.4 C1CN(CCN1)C(=S)SCC2=CN(N=N2)CC3=CC(=C(C=C3)Cl)Cl IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BEP0O1 [1-[(4-Fluorophenyl)methyl]triazol-4-yl]methyl piperazine-1-carbodithioate Investigative 71652979 C15H18FN5S2 351.5 C1CN(CCN1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)F IC50 = 69300 nM Poor binder T16739 Lysine-specific histone demethylase 1 BEU12R Tert-butyl 4-[[1-(2-fluorophenyl)triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71616593 C19H24FN5O2S2 437.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)C3=CC=CC=C3F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BEX84G Tert-butyl 4-[[1-[(4-nitrophenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713320 C20H26N6O4S2 478.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)[N+](=O)[O-] IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BF1T2R [1-[(4-Fluorophenyl)methyl]triazol-4-yl]methyl 4-methylsulfonylpiperazine-1-carbodithioate Investigative 72714201 C16H20FN5O2S3 429.6 CS(=O)(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)F IC50 = 55100 nM Poor binder T16739 Lysine-specific histone demethylase 1 BF61LR Chembl4250459 Investigative 145985822 C19H17BrN2O5 433.3 COC1=C(C=C(C=C1)CC2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)OC IC50 ~ 75000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BF61RH Tert-butyl 4-[[1-[(2,6-difluorophenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71616473 C20H25F2N5O2S2 469.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=C(C=CC=C3F)F IC50 = 51200 nM Poor binder T16739 Lysine-specific histone demethylase 1 BG7W6P (1S,2S)-2-Fluoro-2-(4-nitrophenyl)cyclopropan-1-amine Investigative 137645133 C9H9FN2O2 196.18 C1[C@@H]([C@]1(C2=CC=C(C=C2)[N+](=O)[O-])F)N IC50 ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BG9B1Q N-[4-(4-Chloro-phenyl)-thiazol-2-yl]-4-methyl-benzenesulfonamide Investigative 10666499 C16H13ClN2O2S2 364.9 CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Cl IC50 = 50500 nM Poor binder T16739 Lysine-specific histone demethylase 1 BGJT18 [1-[(4-Fluorophenyl)methyl]triazol-4-yl]methyl 4-phenylpiperazine-1-carbodithioate Investigative 72713977 C21H22FN5S2 427.6 C1CN(CCN1C2=CC=CC=C2)C(=S)SCC3=CN(N=N3)CC4=CC=C(C=C4)F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BI7G8K 2-(4-Cyano-N-(4-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide Investigative 137656309 C21H18N4O3S 406.5 CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CN=CC=C2)C3=CC=C(C=C3)C#N IC50 ~ 150000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BIFS87 Tert-butyl 4-[[1-[2-(4-fluorophenyl)ethyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713324 C21H28FN5O2S2 465.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CCC3=CC=C(C=C3)F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BJ79MU (2S)-2-[[(2S)-2-[[(2S)-5-Amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[2-[[2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2R)-2-aminopropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]amino]-5-oxopentanoyl]amino]-3-hydroxybutanoyl]amino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-6-(3,6-dihydro-2H-pyridin-1-yl)hexanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]acetyl]amino]hexanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]amino]hexanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]propanoic acid Investigative 118728858 C99H178N36O28 2320.7 C[C@@H]([C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN1CCC=CC1)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@H](C)O)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H]([C@H](C)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)N)O IC50 = 88000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BJLD38 4-[2-(4-Methylphenyl)-5-(piperidin-4-ylmethoxy)pyridin-3-yl]benzoic acid Investigative 127028981 C25H26N2O3 402.5 CC1=CC=C(C=C1)C2=C(C=C(C=N2)OCC3CCNCC3)C4=CC=C(C=C4)C(=O)O Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BJOF29 N-[2-(2-Aminocyclopropyl)phenyl]benzamide;hydrochloride Investigative 118734099 C16H17ClN2O 288.77 C1C(C1N)C2=CC=CC=C2NC(=O)C3=CC=CC=C3.Cl IC50 = 74650 nM Poor binder T16739 Lysine-specific histone demethylase 1 BJPU92 4-(4-Methoxyanilino)-6-phenyl-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 118713036 C21H16N4OS 372.4 COC1=CC=C(C=C1)NC2=NC(=NC(=C2C#N)C3=CC=CC=C3)SCC#C IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BK5Q1A Tert-butyl (2S)-2-benzamido-6-(but-2-ynylamino)hexanoate Investigative 73334475 C21H30N2O3 358.5 CC#CCNCCCC[C@@H](C(=O)OC(C)(C)C)NC(=O)C1=CC=CC=C1 IC50 = 131900 nM Poor binder T16739 Lysine-specific histone demethylase 1 BKF4M6 [4-[2-(4-Methylphenyl)-5-(piperidin-4-ylmethoxy)pyridin-3-yl]phenyl]-piperidin-1-ylmethanone Investigative 127028983 C30H35N3O2 469.6 CC1=CC=C(C=C1)C2=C(C=C(C=N2)OCC3CCNCC3)C4=CC=C(C=C4)C(=O)N5CCCCC5 Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BKJ8G4 1-[2-(2-Methylanilino)-1,3-thiazol-4-yl]ethanone Investigative 76329395 C12H12N2OS 232.3 CC1=CC=CC=C1NC2=NC(=CS2)C(=O)C IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BL05PX 3-(4-Ethynylphenyl)-2-(4-methylphenyl)-5-(piperidin-4-ylmethoxy)pyridine Investigative 127028664 C26H26N2O 382.5 CC1=CC=C(C=C1)C2=C(C=C(C=N2)OCC3CCNCC3)C4=CC=C(C=C4)C#C Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BL7H6Q [1-[(4-Methylphenyl)methyl]triazol-4-yl]methyl piperidine-1-carbodithioate Investigative 72714190 C17H22N4S2 346.5 CC1=CC=C(C=C1)CN2C=C(N=N2)CSC(=S)N3CCCCC3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BL9N1W [1-[(4-Chlorophenyl)methyl]triazol-4-yl]methyl piperazine-1-carbodithioate Investigative 71652981 C15H18ClN5S2 367.9 C1CN(CCN1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)Cl IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BLAO26 [1-[(2-Fluorophenyl)methyl]triazol-4-yl]methyl 4-phenylpiperazine-1-carbodithioate Investigative 72713976 C21H22FN5S2 427.6 C1CN(CCN1C2=CC=CC=C2)C(=S)SCC3=CN(N=N3)CC4=CC=CC=C4F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BLG8U6 4-(4-Methoxyanilino)-2-prop-2-ynylsulfanyl-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile Investigative 118733316 C24H22N4O4S 462.5 COC1=CC=C(C=C1)NC2=NC(=NC(=C2C#N)C3=CC(=C(C(=C3)OC)OC)OC)SCC#C IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BLVC31 Tert-butyl 4-[[1-[(7-fluoro-2-oxochromen-4-yl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 73055053 C23H26FN5O4S2 519.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC(=O)OC4=C3C=CC(=C4)F IC50 = 84200 nM Poor binder T16739 Lysine-specific histone demethylase 1 BM02TG (1R,2S)-2-(3-Phenylphenyl)cyclopropan-1-amine;hydrochloride Investigative 56683887 C15H16ClN 245.74 C1[C@H]([C@@H]1N)C2=CC=CC(=C2)C3=CC=CC=C3.Cl Ki ~ 100000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BM9W8C [1-[(2-Fluorophenyl)methyl]triazol-4-yl]methyl piperidine-1-carbodithioate Investigative 72714188 C16H19FN4S2 350.5 C1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BMB6X9 (1S,2S)-2-(4-Ethoxyphenyl)-2-fluorocyclopropan-1-amine Investigative 137641024 C11H14FNO 195.23 CCOC1=CC=C(C=C1)[C@]2(C[C@@H]2N)F IC50 ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BN1K7J N-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]-4-methoxybenzenesulfonamide Investigative 76311323 C16H13ClN2O3S2 380.9 COC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Cl IC50 = 76050 nM Poor binder T16739 Lysine-specific histone demethylase 1 BN9H8S [1-[(4-Chlorophenyl)methyl]triazol-4-yl]methyl morpholine-4-carbodithioate Investigative 72713114 C15H17ClN4OS2 368.9 C1COCCN1C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)Cl IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BNW52O 1-Amino-2-phenylcyclopropanecarboxylic acid, cis- Investigative 10910111 C10H11NO2 177.2 C1[C@H]([C@@]1(C(=O)O)N)C2=CC=CC=C2 IC50 ~ 100000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BO37PG [4-[2-(4-Methylphenyl)-5-(piperidin-4-ylmethoxy)pyridin-3-yl]phenyl]-morpholin-4-ylmethanone Investigative 127024901 C29H33N3O3 471.6 CC1=CC=C(C=C1)C2=C(C=C(C=N2)OCC3CCNCC3)C4=CC=C(C=C4)C(=O)N5CCOCC5 Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BO4QS9 1-{2-[(4-Methoxyphenyl)amino]-1,3-thiazol-4-yl}ethan-1-one Investigative 76336665 C12H12N2O2S 248.3 CC(=O)C1=CSC(=N1)NC2=CC=C(C=C2)OC IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BO6UJ8 2,3-Diphenyl-5-(piperidin-4-ylmethoxy)pyridine Investigative 127024955 C23H24N2O 344.4 C1CNCCC1COC2=CC(=C(N=C2)C3=CC=CC=C3)C4=CC=CC=C4 Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BOI1Q2 1-[Methyl(prop-2-ynyl)amino]-3-naphthalen-2-yloxypropan-2-ol Investigative 73334588 C17H19NO2 269.34 CN(CC#C)CC(COC1=CC2=CC=CC=C2C=C1)O IC50 = 51700 nM Poor binder T16739 Lysine-specific histone demethylase 1 BOK2U5 Tert-butyl 4-[[1-[(2-hydroxyphenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71616359 C20H27N5O3S2 449.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3O IC50 = 69200 nM Poor binder T16739 Lysine-specific histone demethylase 1 BOK96L [1-[(4-Fluorophenyl)methyl]triazol-4-yl]methyl 4-methylpiperazine-1-carbodithioate Investigative 72713760 C16H20FN5S2 365.5 CN1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BOS5B8 4-(4-Chlorophenyl)-6-(4-methoxyanilino)-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 118733313 C21H15ClN4OS 406.9 COC1=CC=C(C=C1)NC2=NC(=NC(=C2C#N)C3=CC=C(C=C3)Cl)SCC#C IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BPC5I4 Tert-butyl 4-[[1-[2-(2-oxochromen-4-yl)oxyethyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713537 C24H29N5O5S2 531.7 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CCOC3=CC(=O)OC4=CC=CC=C43 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BPFA52 Tert-butyl 4-[[1-[(3,4-dichlorophenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71616471 C20H25Cl2N5O2S2 502.5 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC(=C(C=C3)Cl)Cl IC50 = 88900 nM Poor binder T16739 Lysine-specific histone demethylase 1 BPFI27 Tert-butyl 4-[[1-[3-(trifluoromethyl)phenyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71653426 C20H24F3N5O2S2 487.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)C3=CC=CC(=C3)C(F)(F)F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BQ5ZR4 Tert-butyl 4-[[1-(1H-benzimidazol-2-ylmethyl)triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713540 C21H27N7O2S2 473.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=NC4=CC=CC=C4N3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BR4CH7 N-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]benzamide Investigative 681700 C16H11ClN2OS 314.8 C1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Cl IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BR8M0Z 4-(4-Methylanilino)-6-phenyl-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 118733312 C21H16N4S 356.4 CC1=CC=C(C=C1)NC2=NC(=NC(=C2C#N)C3=CC=CC=C3)SCC#C IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BS16MV 3-Chloro-N-(4-phenyl-1,3-thiazol-2-yl)benzenesulfonamide Investigative 3132916 C15H11ClN2O2S2 350.8 C1=CC=C(C=C1)C2=CSC(=N2)NS(=O)(=O)C3=CC(=CC=C3)Cl IC50 = 51600 nM Poor binder T16739 Lysine-specific histone demethylase 1 BS8B9Q [1-[(2-Fluorophenyl)methyl]triazol-4-yl]methyl 4-benzylpiperazine-1-carbodithioate Investigative 71616589 C22H24FN5S2 441.6 C1CN(CCN1CC2=CC=CC=C2)C(=S)SCC3=CN(N=N3)CC4=CC=CC=C4F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BSE4H7 Tert-butyl 4-[[1-[[4-(trifluoromethyl)phenyl]methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713117 C21H26F3N5O2S2 501.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)C(F)(F)F IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BSJV83 2-Phenyl-5-(piperidin-4-ylmethoxy)pyridine Investigative 127025530 C17H20N2O 268.35 C1CNCCC1COC2=CN=C(C=C2)C3=CC=CC=C3 Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BT56XP 2-[5-[(3R)-3-Aminopiperidine-1-carbonyl]-2-(4-cyanophenyl)pyrazol-3-yl]oxyacetamide Investigative 137639034 C18H20N6O3 368.4 C1C[C@H](CN(C1)C(=O)C2=NN(C(=C2)OCC(=O)N)C3=CC=C(C=C3)C#N)N IC50 ~ 150000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BU46LX 1-Naphthalen-2-yloxy-3-(prop-2-ynylamino)propan-2-ol Investigative 73334589 C16H17NO2 255.31 C#CCNCC(COC1=CC2=CC=CC=C2C=C1)O IC50 = 92200 nM Poor binder T16739 Lysine-specific histone demethylase 1 BU6A3I (1-Benzyltriazol-4-yl)methyl morpholine-4-carbodithioate Investigative 72714193 C15H18N4OS2 334.5 C1COCCN1C(=S)SCC2=CN(N=N2)CC3=CC=CC=C3 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BU7V3N 4-[2-(4-Methylphenyl)-5-phenylmethoxypyridin-3-yl]benzonitrile Investigative 127025221 C26H20N2O 376.4 CC1=CC=C(C=C1)C2=C(C=C(C=N2)OCC3=CC=CC=C3)C4=CC=C(C=C4)C#N Ki ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BUN8R3 Tert-butyl 4-[[1-[(2-oxo-1H-quinolin-4-yl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 72713539 C23H28N6O3S2 500.6 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC(=O)NC4=CC=CC=C43 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BV1O3Y 1-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]-3-phenylurea Investigative 897193 C16H12ClN3OS 329.8 C1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Cl IC50 ~ 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BVO6K9 trans-2-Phenylcyclopropylamine Investigative 26070 C9H11N 133.19 C1[C@@H]([C@H]1N)C2=CC=CC=C2 Ki = 168000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BW04JO Tert-butyl 4-[[1-[(4-chlorophenyl)methyl]triazol-4-yl]methylsulfanylcarbothioyl]piperazine-1-carboxylate Investigative 71616358 C20H26ClN5O2S2 468 CC(C)(C)OC(=O)N1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)Cl IC50 = 56500 nM Poor binder T16739 Lysine-specific histone demethylase 1 BW19LA [1-[(4-Methylphenyl)methyl]triazol-4-yl]methyl 4-benzylpiperazine-1-carbodithioate Investigative 71616591 C23H27N5S2 437.6 CC1=CC=C(C=C1)CN2C=C(N=N2)CSC(=S)N3CCN(CC3)CC4=CC=CC=C4 IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BW25IF [1-[(4-Chlorophenyl)methyl]triazol-4-yl]methyl piperidine-1-carbodithioate Investigative 72714192 C16H19ClN4S2 366.9 C1CCN(CC1)C(=S)SCC2=CN(N=N2)CC3=CC=C(C=C3)Cl IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BW37LB 4-Chloro-6-(3-chlorophenyl)-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 87057441 C14H7Cl2N3S 320.2 C#CCSC1=NC(=C(C(=N1)Cl)C#N)C2=CC(=CC=C2)Cl IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BX4J8M (1S,2R)-2-Fluoro-2-(4-nitrophenyl)cyclopropan-1-amine Investigative 137639972 C9H9FN2O2 196.18 C1[C@@H]([C@@]1(C2=CC=C(C=C2)[N+](=O)[O-])F)N IC50 ~ 50000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BX5KM9 2-[[5-Cyano-6-(4-nitrophenyl)-2-prop-2-ynylsulfanylpyrimidin-4-yl]amino]guanidine Investigative 87056309 C15H12N8O2S 368.4 C#CCSC1=NC(=C(C(=N1)NN=C(N)N)C#N)C2=CC=C(C=C2)[N+](=O)[O-] IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BXU7N8 Tert-butyl (2S)-2-benzamido-6-(prop-2-ynylamino)hexanoate Investigative 73334474 C20H28N2O3 344.4 CC(C)(C)OC(=O)[C@H](CCCCNCC#C)NC(=O)C1=CC=CC=C1 IC50 = 143600 nM Poor binder T16739 Lysine-specific histone demethylase 1 BY3PX8 2-(4-Methoxyphenyl)cyclopropan-1-amine Investigative 3082143 C10H13NO 163.22 COC1=CC=C(C=C1)C2CC2N Ki = 188000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BYV51W 4-(4-Chlorophenyl)-2-prop-2-ynylsulfanyl-6-[3-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile Investigative 118733314 C21H12ClF3N4S 444.9 C#CCSC1=NC(=C(C(=N1)NC2=CC=CC(=C2)C(F)(F)F)C#N)C3=CC=C(C=C3)Cl IC50 ~ 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BZ81LT 4-(4-Fluoroanilino)-6-phenyl-2-prop-2-ynylsulfanylpyrimidine-5-carbonitrile Investigative 118733310 C20H13FN4S 360.4 C#CCSC1=NC(=C(C(=N1)NC2=CC=C(C=C2)F)C#N)C3=CC=CC=C3 IC50 = 125000 nM Poor binder T16739 Lysine-specific histone demethylase 1 BZ97KN [[5-Cyano-2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(3,4,5-trimethoxyphenyl)pyrimidin-4-yl]amino]thiourea Investigative 118733321 C22H20Cl2N6O3S2 551.5 COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=N2)SCC3=CC(=C(C=C3)Cl)Cl)NNC(=S)N)C#N IC50 = 98174.79 nM Poor binder T16739 Lysine-specific histone demethylase 1 BZCX31 1-[2-(2-Chloroanilino)thiazole-4-yl]ethanone Investigative 2744808 C11H9ClN2OS 252.72 CC(=O)C1=CSC(=N1)NC2=CC=CC=C2Cl IC50 ~ 188000 nM Poor binder