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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vasopressin V2 receptor (V2)' and Ligand = 'BDBM50397214'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Vasopressin V2 receptor (V2)


(Homo sapiens (Human))
BDBM50397214
PNG
(CHEMBL2172390)
Show SMILES CCN(CC)c1ccc2c(-c3ccc(cc3S([O-])(=O)=O)S(=O)(=O)NC3CCCN(C(=O)c4ccc(NC(=O)c5ccccc5-c5ccccc5)cc4)c4ccccc34)c3ccc(cc3oc2c1)=[N+](CC)CC
Show InChI InChI=1S/C57H55N5O8S2/c1-5-60(6-2)41-28-31-47-52(35-41)70-53-36-42(61(7-3)8-4)29-32-48(53)55(47)49-33-30-43(37-54(49)72(67,68)69)71(65,66)59-50-22-16-34-62(51-23-15-14-21-46(50)51)57(64)39-24-26-40(27-25-39)58-56(63)45-20-13-12-19-44(45)38-17-10-9-11-18-38/h9-15,17-21,23-33,35-37,50,59H,5-8,16,22,34H2,1-4H3,(H-,58,63,64,67,68,69)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
25.3n/an/an/an/an/an/an/an/a



UMR7200 CNRS/Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Displacement of [3H]-AVP from human vasopressin V2 receptor expressed in CHO cells after 30 mins


J Med Chem 55: 8588-602 (2012)


Article DOI: 10.1021/jm3006146
BindingDB Entry DOI: 10.7270/Q28G8MT5
More data for this
Ligand-Target Pair