TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T92424 Integrin alpha-V/beta-5 B1FEL6 (2S)-3-[[2-[(3R,5S)-1-(3,3-Dimethylbutanoyl)-5-[(pyridin-2-ylamino)methyl]pyrrolidin-3-yl]oxyacetyl]amino]-2-[(2,4,6-trimethylbenzoyl)amino]propanoic acid Investigative 11613998 C31H43N5O6 581.7 CC1=CC(=C(C(=C1)C)C(=O)N[C@@H](CNC(=O)CO[C@@H]2C[C@H](N(C2)C(=O)CC(C)(C)C)CNC3=CC=CC=N3)C(=O)O)C IC50 ~ 50000 nM Poor binder T92424 Integrin alpha-V/beta-5 B85FRU (2S)-2-[[2-[[(2S)-2-[[(2S)-2-Amino-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]butanedioic acid Investigative 90645591 C21H31N7O7 493.5 C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)N IC50 = 80000 nM Poor binder T92424 Integrin alpha-V/beta-5 BPEW05 (2S)-3-[[2-[(3S,5R)-1-(3,3-Dimethylbutanoyl)-5-[(pyridin-2-ylamino)methyl]pyrrolidin-3-yl]oxyacetyl]amino]-2-[(2,4,6-trimethylbenzoyl)amino]propanoic acid Investigative 46226894 C31H43N5O6 581.7 CC1=CC(=C(C(=C1)C)C(=O)N[C@@H](CNC(=O)CO[C@H]2C[C@@H](N(C2)C(=O)CC(C)(C)C)CNC3=CC=CC=N3)C(=O)O)C IC50 = 90700 nM Poor binder T92424 Integrin alpha-V/beta-5 BWD4J9 Arginyl-glycyl-aspartyl-phenylalanine Investigative 3080994 C21H31N7O7 493.5 C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCN=C(N)N)N IC50 = 92000 nM Poor binder