TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T50970 Endothelin-converting enzyme 1 B16HUV (R)-2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-3-phenyl-propionic acid Investigative 44275764 C35H37N2O7P 628.6 C1=CC=C(C=C1)C[C@H](C(=O)O)NC(=O)C(CC2=CC=CC=C2)CP(=O)([C@H](CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)O IC50 ~ 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 B2TY4V (R)-2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-5-guanidino-pentanoic acid Investigative 44275795 C32H40N5O7P 637.7 C1=CC=C(C=C1)C[C@H](NC(=O)OCC2=CC=CC=C2)P(=O)(CC(CC3=CC=CC=C3)C(=O)N[C@H](CCCN=C(N)N)C(=O)O)O IC50 ~ 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 B38MAX (S)-3-(1H-Indol-3-yl)-2-((S)-2-mercapto-4-methyl-pentanoylamino)-propionic acid Investigative 44301375 C17H22N2O3S 334.4 CC(C)C[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)S IC50 = 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 B4F7WP (R)-2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-3-methyl-butyric acid Investigative 44275416 C31H37N2O7P 580.6 CC(C)[C@H](C(=O)O)NC(=O)C(CC1=CC=CC=C1)CP(=O)([C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O IC50 = 60000 nM Poor binder T50970 Endothelin-converting enzyme 1 B4LGA0 2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-4-carbamoyl-butyric acid Investigative 44275869 C31H36N3O8P 609.6 C1=CC=C(C=C1)C[C@H](NC(=O)OCC2=CC=CC=C2)P(=O)(CC(CC3=CC=CC=C3)C(=O)NC(CCC(=O)N)C(=O)O)O IC50 ~ 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 B7JD5C 4,5-Dimethoxy-6-thiophen-3-yl-pyridine-2-carboxylic acid Investigative 44307703 C12H11NO4S 265.29 COC1=CC(=NC(=C1OC)C2=CSC=C2)C(=O)O IC50 ~ 50000 nM Poor binder T50970 Endothelin-converting enzyme 1 B7L8FJ 4,5-Dimethoxy-6-(1-methyl-1H-pyrrol-2-yl)-pyridine-2-carboxylic acid Investigative 44307702 C13H14N2O4 262.26 CN1C=CC=C1C2=C(C(=CC(=N2)C(=O)O)OC)OC IC50 ~ 50000 nM Poor binder T50970 Endothelin-converting enzyme 1 B8VN0Q (2R,3S)-2-[[2-Benzyl-3-[hydroxy-[(1R)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]propanoyl]amino]-3-hydroxybutanoic acid Investigative 56668219 C30H35N2O8P 582.6 C[C@@H]([C@H](C(=O)O)NC(=O)C(CC1=CC=CC=C1)CP(=O)([C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O)O IC50 ~ 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 BB01LM (R)-2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-pentanedioic acid Investigative 44275871 C31H35N2O9P 610.6 C1=CC=C(C=C1)C[C@H](NC(=O)OCC2=CC=CC=C2)P(=O)(CC(CC3=CC=CC=C3)C(=O)N[C@H](CCC(=O)O)C(=O)O)O IC50 ~ 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 BBJ5U9 (2S)-2-[[(2S)-2-[[Ethoxy(hydroxy)phosphoryl]amino]-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid Investigative 10342348 C19H28N3O6P 425.4 CCOP(=O)(N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)O IC50 = 109000 nM Poor binder T50970 Endothelin-converting enzyme 1 BD2V9Y N-(Carboxymethyl)-N-(3-Phenylpropyl)glycyl-N-Methyl-L-Histidinamide Investigative 54589400 C20H27N5O4 401.5 CNC(=O)[C@H](CC1=CN=CN1)NC(=O)CN(CCCC2=CC=CC=C2)CC(=O)O IC50 ~ 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 BDHM17 N-(Benzylphosphonyl)-L-Leu-L-Trp-OH Investigative 10344688 C24H30N3O5P 471.5 CC(C)C[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NP(=O)(CC3=CC=CC=C3)O IC50 = 61000 nM Poor binder T50970 Endothelin-converting enzyme 1 BJ63ZY 6-Amino-2-{2-benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-hexanoic acid Investigative 44275713 C32H40N3O7P 609.6 C1=CC=C(C=C1)C[C@H](NC(=O)OCC2=CC=CC=C2)P(=O)(CC(CC3=CC=CC=C3)C(=O)NC(CCCCN)C(=O)O)O IC50 = 60000 nM Poor binder T50970 Endothelin-converting enzyme 1 BJU2E4 2-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-3-methyl-butyric acid Investigative 44275937 C31H37N2O7P 580.6 CC(C)C(C(=O)O)NC(=O)C(CC1=CC=CC=C1)CP(=O)([C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O IC50 = 80000 nM Poor binder T50970 Endothelin-converting enzyme 1 BK2X0P (3S)-3-(Benzenesulfonyl)-N-hydroxyheptanamide Investigative 10613145 C13H19NO4S 285.36 CCCC[C@@H](CC(=O)NO)S(=O)(=O)C1=CC=CC=C1 IC50 ~ 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 BM3T4J {2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-acetic acid Investigative 44275916 C28H31N2O7P 538.5 C1=CC=C(C=C1)C[C@H](NC(=O)OCC2=CC=CC=C2)P(=O)(CC(CC3=CC=CC=C3)C(=O)NCC(=O)O)O IC50 = 80000 nM Poor binder T50970 Endothelin-converting enzyme 1 BR1D6T (S)-3-(1H-Indol-3-yl)-2-((R)-2-mercapto-4-methyl-pentanoylamino)-propionic acid Investigative 44301550 C17H22N2O3S 334.4 CC(C)C[C@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)S IC50 = 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 BTU97O Thiorphan Investigative 3132 C12H15NO3S 253.32 C1=CC=C(C=C1)CC(CS)C(=O)NCC(=O)O IC50 ~ 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 BVYS37 6-Furan-3-yl-4,5-dimethoxy-pyridine-2-carboxylic acid Investigative 44307550 C12H11NO5 249.22 COC1=CC(=NC(=C1OC)C2=COC=C2)C(=O)O IC50 ~ 50000 nM Poor binder T50970 Endothelin-converting enzyme 1 BW65DQ (3R)-3-(Benzenesulfonyl)-N-hydroxyheptanamide Investigative 10493383 C13H19NO4S 285.36 CCCC[C@H](CC(=O)NO)S(=O)(=O)C1=CC=CC=C1 IC50 ~ 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 BZSW70 3-{2-Benzyl-3-[((R)-1-benzyloxycarbonylamino-2-phenyl-ethyl)-hydroxy-phosphinoyl]-propionylamino}-propionic acid Investigative 44275459 C29H33N2O7P 552.6 C1=CC=C(C=C1)C[C@H](NC(=O)OCC2=CC=CC=C2)P(=O)(CC(CC3=CC=CC=C3)C(=O)NCCC(=O)O)O IC50 = 50000 nM Poor binder T50970 Endothelin-converting enzyme 1 D02BTV 3-Benzenesulfinyl-heptanoic acid hydroxyamide Investigative 9816867 C13H19NO3S 269.36 CCCCC(CC(=O)NO)S(=O)C1=CC=CC=C1 IC50 ~ 100000 nM Poor binder T50970 Endothelin-converting enzyme 1 D08ELY 3-Benzenesulfonyl-heptanoic acid hydroxyamide Investigative 9838786 C13H19NO4S 285.36 CCCCC(CC(=O)NO)S(=O)(=O)C1=CC=CC=C1 IC50 ~ 50000 nM Poor binder T50970 Endothelin-converting enzyme 1 D0N6CD 3-Cyclohexanesulfonyl-heptanoic acid hydroxyamide Investigative 10565532 C13H25NO4S 291.41 CCCCC(CC(=O)NO)S(=O)(=O)C1CCCCC1 IC50 = 78000 nM Poor binder