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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.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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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	CHEMBL553710
Molecular formula	C51H73N13O11S2
IUPAC name	N-[1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[13-(2-amino-2-oxoethyl)-19-benzyl-22-[(4-hydroxyphenyl)methyl]-12,15,18,21,24-pentaoxo-16-propan-2-yl-7,8-dithia-11,14,17,20,23-pentazaspiro[5.19]pentacosane-10-carbonyl]pyrrolidine-2-carboxamide
Molecular weight	1108.34
Hydrogen bond acceptor	14
Hydrogen bond donor	12
XlogP	-0.3
Synonyms	BDBM50414477
Inchi Key	FTPKAQCWQHOBMR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C51H73N13O11S2/c1-29(2)42-48(74)61-36(25-39(52)66)45(71)62-37(49(75)64-22-10-14-38(64)47(73)59-33(13-9-21-56-50(54)55)43(69)57-27-40(53)67)28-76-77-51(19-7-4-8-20-51)26-41(68)58-34(24-31-15-17-32(65)18-16-31)44(70)60-35(46(72)63-42)23-30-11-5-3-6-12-30/h3,5-6,11-12,15-18,29,33-38,42,65H,4,7-10,13-14,19-28H2,1-2H3,(H2,52,66)(H2,53,67)(H,57,69)(H,58,68)(H,59,73)(H,60,70)(H,61,74)(H,62,71)(H,63,72)(H4,54,55,56)
PubChem CID	44364402
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50414477
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
Kd	4.47 nM	PMID19418631	BindingDB

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