TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T34234 Vitamin D3 receptor B43ACG (3R,6S,9S,15R)-15-[[(2S)-2-[[(2S)-2-Amino-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-12,12-dimethyl-6,9-bis(2-methylpropyl)-5,8,11,14-tetraoxo-1,17-dioxa-4,7,10,13-tetrazacyclohenicosane-3-carboxylic acid Investigative 71725364 C38H69N7O10 784 CC(C)C[C@H]1C(=O)N[C@H](COCCCCOC[C@H](C(=O)NC(C(=O)N[C@H](C(=O)N1)CC(C)C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N)C(=O)O IC50 = 600000 nM Non binder T34234 Vitamin D3 receptor B4K8BO (3S,6S,9S,15S)-15-[[(2S)-2-[[(2S)-2-Amino-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-12,12-dimethyl-6,9-bis(2-methylpropyl)-5,8,11,14-tetraoxo-1,18-dioxa-4,7,10,13-tetrazacyclodocosane-3-carboxylic acid Investigative 71725365 C39H71N7O10 798 CC(C)C[C@H]1C(=O)N[C@@H](COCCCCOCC[C@@H](C(=O)NC(C(=O)N[C@H](C(=O)N1)CC(C)C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N)C(=O)O IC50 = 520000 nM Non binder T34234 Vitamin D3 receptor B6ZSH9 (3S,6S,9S,15R)-15-[[(2S)-2-[[(2S)-2-Amino-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-12,12-dimethyl-6,9-bis(2-methylpropyl)-5,8,11,14-tetraoxo-1,17-dioxa-4,7,10,13-tetrazacyclohenicosane-3-carboxylic acid Investigative 71725533 C38H69N7O10 784 CC(C)C[C@H]1C(=O)N[C@@H](COCCCCOC[C@H](C(=O)NC(C(=O)N[C@H](C(=O)N1)CC(C)C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N)C(=O)O IC50 = 610000 nM Non binder T34234 Vitamin D3 receptor BC4MX8 (4S,7S,10S,16S)-16-[[(2S)-2-[[(2S)-2-Amino-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-13,13-dimethyl-7,10-bis(2-methylpropyl)-6,9,12,15-tetraoxo-1,19-dioxa-5,8,11,14-tetrazacyclotricosane-4-carboxylic acid Investigative 71725438 C40H73N7O10 812 CC(C)C[C@H]1C(=O)N[C@@H](CCOCCCCOCC[C@@H](C(=O)NC(C(=O)N[C@H](C(=O)N1)CC(C)C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N)C(=O)O IC50 = 220000 nM Non binder T34234 Vitamin D3 receptor BCL63V (3R,6S,9S,15S)-15-[[(2S)-2-[[(2S)-2-Amino-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-12,12-dimethyl-6,9-bis(2-methylpropyl)-5,8,11,14-tetraoxo-1,17-dioxa-4,7,10,13-tetrazacyclohenicosane-3-carboxylic acid Investigative 71725532 C38H69N7O10 784 CC(C)C[C@H]1C(=O)N[C@H](COCCCCOC[C@@H](C(=O)NC(C(=O)N[C@H](C(=O)N1)CC(C)C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N)C(=O)O IC50 = 430000 nM Non binder T34234 Vitamin D3 receptor BK80NI (3S,6S,9S,15S)-15-[[(2S)-2-[[(2S)-2-Amino-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-12,12-dimethyl-6,9-bis(2-methylpropyl)-5,8,11,14-tetraoxo-1,17-dioxa-4,7,10,13-tetrazacyclohenicosane-3-carboxylic acid Investigative 71725531 C38H69N7O10 784 CC(C)C[C@H]1C(=O)N[C@@H](COCCCCOC[C@@H](C(=O)NC(C(=O)N[C@H](C(=O)N1)CC(C)C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N)C(=O)O IC50 = 610000 nM Non binder T34234 Vitamin D3 receptor BWZ7I1 (2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-prop-2-enoxybutanoyl]amino]-2-methylpropanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-prop-2-enoxybutanoic acid Investigative 118727102 C42H75N7O10 838.1 CC(C)C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCOCC=C)C(=O)NC(C)(C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCOCC=C)C(=O)O)N IC50 = 500000 nM Non binder