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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	Vasopressin V1a receptor
Species	Rattus norvegicus (Rat)
Gene	Avpr1a
Synonym	AVPR AVPR V1a AVPR1 antidiuretic hormone receptor 1a V1A receptor V1aR Vascular/hepatic-type arginine vasopressin receptor [ Show all ]
Disease	N/A for non-human GPCRs
Length	424
Amino acid sequence	MSFPRGSQDRSVGNSSPWWPLTTEGSNGSQEAARLGEGDSPLGDVRNEELAKLEIAVLAVIFVVAVLGNSSVLLALHRTPRKTSRMHLFIRHLSLADLAVAFFQVLPQLCWDITYRFRGPDWLCRVVKHLQVFAMFASAYMLVVMTADRYIAVCHPLKTLQQPARRSRLMIATSWVLSFILSTPQYFIFSVIEIEVNNGTKTQDCWATFIQPWGTRAYVTWMTSGVFVAPVVVLGTCYGFICYHIWRNIRGKTASSRHSKGDKGSGEAVGPFHKGLLVTPCVSSVKSISRAKIRTVKMTFVIVSAYILCWAPFFIVQMWSVWDENFIWTDSENPSITITALLASLNSCCNPWIYMFFSGHLLQDCVQSFPCCHSMAQKFAKDDSDSMSRRQTSYSNNRSPTNSTGMWKDSPKSSKSIRFIPVST
UniProt	P30560
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2868
IUPHAR	366
DrugBank	N/A

Ligand

Name	CHEMBL61578
Molecular formula	C21H21N3O4
IUPAC name	1-[1-(2-nitrobenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one
Molecular weight	379.416
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	2.8
Synonyms	BDBM50045172 1-[1-(2-Nitro-benzoyl)-piperidin-4-yl]-3,4-dihydro-1H-quinolin-2-one
Inchi Key	FRVWVSVRVLQCGP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H21N3O4/c25-20-10-9-15-5-1-3-7-18(15)23(20)16-11-13-22(14-12-16)21(26)17-6-2-4-8-19(17)24(27)28/h1-8,16H,9-14H2
PubChem CID	14969518
ChEMBL	CHEMBL61578
IUPHAR	N/A
BindingDB	50045172
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	8400.0 nM	PMID8393113	BindingDB,ChEMBL

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