Reaction Details Report a problem with these data
Target
Vasopressin V1a receptor
Ligand
BDBM50077217
Substrate
n/a
Meas. Tech.
ChEMBL_2071782 (CHEMBL4727316)
Ki
5.5±n/a nM
Citation
 Szántó, G; Makó, A; Baska, F; Bozó, É; Domány-Kovács, K; Kurkó, D; Cselenyák, A; Mohácsi, R; Kordás, KS; Bata, I New V1a receptor antagonist. Part 1. Synthesis and SAR development of urea derivatives. Bioorg Med Chem Lett 30:0 (2020) [PubMed]  Article 
Target
Name:
Vasopressin V1a receptor
Synonyms:
AVPR V1a | AVPR1 | AVPR1A | Antidiuretic hormone receptor 1a | V1AR_HUMAN | V1aR | VASOPRESSIN V1A | Vascular/hepatic-type arginine vasopressin receptor | Vasopressin V1 receptor | Vasopressin V1a receptor | Vasopressin receptor
Type:
Receptor
Mol. Mass.:
46820.18
Organism:
Homo sapiens (Human)
Description:
P37288
Residue:
418
Sequence:
MRLSAGPDAGPSGNSSPWWPLATGAGNTSREAEALGEGNGPPRDVRNEELAKLEIAVLAVTFAVAVLGNSSVLLALHRTPRKTSRMHLFIRHLSLADLAVAFFQVLPQMCWDITYRFRGPDWLCRVVKHLQVFGMFASAYMLVVMTADRYIAVCHPLKTLQQPARRSRLMIAAAWVLSFVLSTPQYFVFSMIEVNNVTKARDCWATFIQPWGSRAYVTWMTGGIFVAPVVILGTCYGFICYNIWCNVRGKTASRQSKGAEQAGVAFQKGFLLAPCVSSVKSISRAKIRTVKMTFVIVTAYIVCWAPFFIIQMWSVWDPMSVWTESENPTITITALLGSLNSCCNPWIYMFFSGHLLQDCVQSFPCCQNMKEKFNKEDTDSMSRRQTFYSNNRSPTNSTGMWKDSPKSSKSIKFIPVST
  
Inhibitor
Name:
BDBM50077217
Synonyms:
CHEMBL3416885
Type:
Small organic molecule
Emp. Form.:
C25H28ClN3O2
Mol. Mass.:
437.962
SMILES:
CN(C)CCn1cc(C(=O)N2CCC3(CC2)OCc2ccccc32)c2ccc(Cl)cc12
Structure:
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