Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Vasopressin V2 receptor' and Ligand = 'BDBM50016309'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Vasopressin V2 receptor (BOVINE)	BDBM50016309 (CHEMBL410025 | [Phe2Sar7]AVP (Arginine-vasopressin...) Show SMILES CN(CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 Show InChI InChI=1S/C44H63N15O11S2/c1-59(21-36(63)53-27(13-8-16-51-44(49)50)38(65)52-20-35(48)62)43(70)32-23-72-71-22-26(45)37(64)55-29(17-24-9-4-2-5-10-24)41(68)56-30(18-25-11-6-3-7-12-25)40(67)54-28(14-15-33(46)60)39(66)57-31(19-34(47)61)42(69)58-32/h2-7,9-12,26-32H,8,13-23,45H2,1H3,(H2,46,60)(H2,47,61)(H2,48,62)(H,52,65)(H,53,63)(H,54,67)(H,55,64)(H,56,68)(H,57,66)(H,58,69)(H4,49,50,51)/t26-,27+,28-,29-,30+,31+,32+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity against plasma membrane from bovine kidney inner medulla using [3H]AVP as a radioligand				J Med Chem 29: 96-9 (1986) BindingDB Entry DOI: 10.7270/Q2P849V1
					More data for this Ligand-Target Pair
Vasopressin V2 receptor (BOVINE)	BDBM50016309 (CHEMBL410025 | [Phe2Sar7]AVP (Arginine-vasopressin...) Show SMILES CN(CC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O)C(=O)[C@@H]1CSSC[C@@H](N)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1 Show InChI InChI=1S/C44H63N15O11S2/c1-59(21-36(63)53-27(13-8-16-51-44(49)50)38(65)52-20-35(48)62)43(70)32-23-72-71-22-26(45)37(64)55-29(17-24-9-4-2-5-10-24)41(68)56-30(18-25-11-6-3-7-12-25)40(67)54-28(14-15-33(46)60)39(66)57-31(19-34(47)61)42(69)58-32/h2-7,9-12,26-32H,8,13-23,45H2,1H3,(H2,46,60)(H2,47,61)(H2,48,62)(H,52,65)(H,53,63)(H,54,67)(H,55,64)(H,56,68)(H,57,66)(H,58,69)(H4,49,50,51)/t26-,27+,28-,29-,30+,31+,32+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity against plasma membrane from bovine kidney inner medulla				J Med Chem 29: 96-9 (1986) BindingDB Entry DOI: 10.7270/Q2P849V1
					More data for this Ligand-Target Pair