BDBM301685 US10131692, Compound 17

SMILES: CCc1ccc(C[C@@H]2NC(=O)CCSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc3cccs3)NC2=O)C(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(N)=N)cc1

InChI Key: InChIKey=CCOKDYRDUMUKDI-USVUHUQMSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 301685   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Vasopressin V1b receptor (Homo sapiens (Human))	BDBM301685 (US10131692, Compound 17) Show SMILES CCc1ccc(C[C@@H]2NC(=O)CCSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc3cccs3)NC2=O)C(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(N)=N)cc1 |r| Show InChI InChI=1S/C45H67N11O9S2/c1-4-27-11-13-28(14-12-27)22-32-39(60)53-33(23-30-9-7-19-67-30)41(62)55-38(26(2)3)43(64)54-34(24-36(46)58)40(61)52-31(15-20-66-21-16-37(59)51-32)44(65)56-18-6-10-35(56)42(63)50-29(25-57)8-5-17-49-45(47)48/h7,9,11-14,19,26,29,31-35,38,57H,4-6,8,10,15-18,20-25H2,1-3H3,(H2,46,58)(H,50,63)(H,51,59)(H,52,61)(H,53,60)(H,54,64)(H,55,62)(H4,47,48,49)/t29-,31+,32+,33+,34+,35+,38+/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	>1.00E+7	n/a	n/a	n/a	n/a
Ferring B.V. US Patent					Assay Description To determine selectivity, compounds were tested in luciferase-based transcriptional reporter gene assays expressing the human V1b receptor (hV1bR). A...				US Patent US10131692 (2018) BindingDB Entry DOI: 10.7270/Q2WQ05TR
					More data for this Ligand-Target Pair
Vasopressin V2 receptor (Homo sapiens (Human))	BDBM301685 (US10131692, Compound 17) Show SMILES CCc1ccc(C[C@@H]2NC(=O)CCSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc3cccs3)NC2=O)C(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)CCCNC(N)=N)cc1 |r| Show InChI InChI=1S/C45H67N11O9S2/c1-4-27-11-13-28(14-12-27)22-32-39(60)53-33(23-30-9-7-19-67-30)41(62)55-38(26(2)3)43(64)54-34(24-36(46)58)40(61)52-31(15-20-66-21-16-37(59)51-32)44(65)56-18-6-10-35(56)42(63)50-29(25-57)8-5-17-49-45(47)48/h7,9,11-14,19,26,29,31-35,38,57H,4-6,8,10,15-18,20-25H2,1-3H3,(H2,46,58)(H,50,63)(H,51,59)(H,52,61)(H,53,60)(H,54,64)(H,55,62)(H4,47,48,49)/t29-,31+,32+,33+,34+,35+,38+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	350	n/a	n/a	n/a	n/a
Ferring B.V. US Patent					Assay Description Agonist activity of compounds on the human V2 receptor (h V2R) was determined in a transcriptional reporter gene assay by transiently transfecting an...				US Patent US10131692 (2018) BindingDB Entry DOI: 10.7270/Q2WQ05TR
					More data for this Ligand-Target Pair