TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T05090 Histone deacetylase 3 D0B7CH Phenylbutyrate Phase 2 4775 C10H12O2 164.2 C1=CC=C(C=C1)CCCC(=O)O IC50 = 260000 nM Non binder T05090 Histone deacetylase 3 B2YIB7 N-((R)-5-((1R,3As,7aR,E)-4-(2-((3R,5R)-3,5-Dihydroxycyclohexylidene)ethylidene)-7a-methyl-octahydro-1H-inden-1-yl)hexyl)butane-1-sulfonamide Investigative 46907280 C28H49NO4S 495.8 CCCCS(=O)(=O)NCCCC[C@@H](C)[C@H]1CC[C@@H]\\2[C@@]1(CCC/C2=C\\C=C3C[C@H](C[C@@H](C3)O)O)C IC50 = 725000 nM Non binder T05090 Histone deacetylase 3 B31LNR N-(2-Aminophenyl)-6-(2,8-diazaspiro[4.5]decan-8-yl)nicotinamide Investigative 24746435 C20H25N5O 351.4 C1CNCC12CCN(CC2)C3=NC=C(C=C3)C(=O)NC4=CC=CC=C4N IC50 = 340000 nM Non binder T05090 Histone deacetylase 3 B37LNB N-(2-Amino-5-(thiophen-3-yl)phenyl)-6-(2,8-diazaspiro[4.5]decan-8-yl)nicotinamide Investigative 24746436 C24H27N5OS 433.6 C1CNCC12CCN(CC2)C3=NC=C(C=C3)C(=O)NC4=C(C=CC(=C4)C5=CSC=C5)N IC50 = 1270000 nM Non binder T05090 Histone deacetylase 3 B3M2YW (2S)-2-Hexyl-N-hydroxy-N'-phenyloctanediamide Investigative 134136160 C20H32N2O3 348.5 CCCCCC[C@@H](CCCCCC(=O)NC1=CC=CC=C1)C(=O)NO IC50 = 530000 nM Non binder T05090 Histone deacetylase 3 B3TCW8 N-Hydroxy-2-propylpentanamide Investigative 88129 C8H17NO2 159.23 CCCC(CCC)C(=O)NO IC50 = 340000 nM Non binder T05090 Histone deacetylase 3 B3X9UO (R)-N-(2-Aminophenyl)-5-((1R,3aS,7aR,E)-4-(2-((3R,5R)-3,5-dihydroxycyclohexylidene)ethylidene)-7a-methyl-octahydro-1H-inden-1-yl)hexanamide Investigative 46907124 C30H44N2O3 480.7 C[C@H](CCCC(=O)NC1=CC=CC=C1N)[C@H]2CC[C@@H]\\3[C@@]2(CCC/C3=C\\C=C4C[C@H](C[C@@H](C4)O)O)C IC50 = 460000 nM Non binder T05090 Histone deacetylase 3 B5F4EH N-((R)-5-((1R,3As,7aR,E)-4-(2-((3R,5R)-3,5-Dihydroxycyclohexylidene)ethylidene)-7a-methyl-octahydro-1H-inden-1-yl)hexyl)trifluoromethanesulfonamide Investigative 46907198 C25H40F3NO4S 507.7 C[C@H](CCCCNS(=O)(=O)C(F)(F)F)[C@H]1CC[C@@H]\\2[C@@]1(CCC/C2=C\\C=C3C[C@H](C[C@@H](C3)O)O)C IC50 = 695000 nM Non binder T05090 Histone deacetylase 3 B61FPY N-(2-Amino-5-(1-methyl-1H-pyrazol-4-yl)phenyl)-6-(2,8-diazaspiro[4.5]decan-8-yl)nicotinamide Investigative 44589911 C24H29N7O 431.5 CN1C=C(C=N1)C2=CC(=C(C=C2)N)NC(=O)C3=CN=C(C=C3)N4CCC5(CCNC5)CC4 IC50 = 5340000 nM Non binder T05090 Histone deacetylase 3 B91PWS (1R,3As,4E,7aR)-4-[2-[(3R,5R)-3,5-dihydroxycyclohexylidene]ethylidene]-7a-methyl-1-[(2R)-6-(sulfamoylamino)hexan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-indene Investigative 46906597 C24H42N2O4S 454.7 C[C@H](CCCCNS(=O)(=O)N)[C@H]1CC[C@@H]\\2[C@@]1(CCC/C2=C\\C=C3C[C@H](C[C@@H](C3)O)O)C IC50 = 470000 nM Non binder T05090 Histone deacetylase 3 BA0F4L N-(2-Amino-5-(thiophen-2-yl)phenyl)-6-(2,8-diazaspiro[4.5]decan-8-yl)nicotinamide Investigative 24746434 C24H27N5OS 433.6 C1CNCC12CCN(CC2)C3=NC=C(C=C3)C(=O)NC4=C(C=CC(=C4)C5=CC=CS5)N IC50 = 1260000 nM Non binder T05090 Histone deacetylase 3 BA8BT9 (E)-3-[4-[3-(1-Adamantyl)-4-(cyanomethyl)phenyl]-3-chlorophenyl]-N-hydroxyprop-2-enamide Investigative 90654946 C27H27ClN2O2 447 C1C2CC3CC1CC(C2)(C3)C4=C(C=CC(=C4)C5=C(C=C(C=C5)/C=C/C(=O)NO)Cl)CC#N IC50 = 340000 nM Non binder T05090 Histone deacetylase 3 BG6M7J N-((R)-5-((1R,3As,7aR,E)-4-(2-((3R,5R)-3,5-Dihydroxycyclohexylidene)ethylidene)-7a-methyl-octahydro-1H-inden-1-yl)hexyl)benzenesulfonamide Investigative 46907281 C30H45NO4S 515.7 C[C@H](CCCCNS(=O)(=O)C1=CC=CC=C1)[C@H]2CC[C@@H]\\3[C@@]2(CCC/C3=C\\C=C4C[C@H](C[C@@H](C4)O)O)C IC50 = 508000 nM Non binder T05090 Histone deacetylase 3 BJ1K2H (1R,3As,4E,7aR)-4-[2-[(3R,5R)-3,5-dihydroxycyclohexylidene]ethylidene]-7a-methyl-1-[(2R)-7-(sulfamoylamino)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-indene Investigative 46906641 C25H44N2O4S 468.7 C[C@H](CCCCCNS(=O)(=O)N)[C@H]1CC[C@@H]\\2[C@@]1(CCC/C2=C\\C=C3C[C@H](C[C@@H](C3)O)O)C IC50 = 605000 nM Non binder T05090 Histone deacetylase 3 BK84SE N-(2-Amino-5-(1-methyl-1H-imidazol-4-yl)phenyl)-6-(2,8-diazaspiro[4.5]decan-8-yl)nicotinamide Investigative 44589913 C24H29N7O 431.5 CN1C=C(N=C1)C2=CC(=C(C=C2)N)NC(=O)C3=CN=C(C=C3)N4CCC5(CCNC5)CC4 IC50 > 30000000 nM Non binder T05090 Histone deacetylase 3 BP2N0X N-((R)-4-((1R,3As,7aR,E)-4-(2-((3R,5R)-3,5-Dihydroxycyclohexylidene)ethylidene)-7a-methyl-octahydro-1H-inden-1-yl)pentyl)methanesulfonamide Investigative 46907196 C24H41NO4S 439.7 C[C@H](CCCNS(=O)(=O)C)[C@H]1CC[C@@H]\\2[C@@]1(CCC/C2=C\\C=C3C[C@H](C[C@@H](C3)O)O)C IC50 = 730000 nM Non binder T05090 Histone deacetylase 3 BQ6U9X N-(2-Amino-5-(1H-pyrazol-3-yl)phenyl)-6-(2,8-diazaspiro[4.5]decan-8-yl)nicotinamide Investigative 44589912 C23H27N7O 417.5 C1CNCC12CCN(CC2)C3=NC=C(C=C3)C(=O)NC4=C(C=CC(=C4)C5=CC=NN5)N IC50 = 5500000 nM Non binder T05090 Histone deacetylase 3 BY9H6R N-((R)-5-((1R,3As,7aR,E)-4-(2-((3R,5R)-3,5-Dihydroxycyclohexylidene)ethylidene)-7a-methyloctahydro-1H-inden-1-yl)hexyl)methanesulfonamide Investigative 46907197 C25H43NO4S 453.7 C[C@H](CCCCNS(=O)(=O)C)[C@H]1CC[C@@H]\\2[C@@]1(CCC/C2=C\\C=C3C[C@H](C[C@@H](C3)O)O)C IC50 = 718000 nM Non binder