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GPCR

Name	Vasopressin V1b receptor
Species	Homo sapiens (Human)
Gene	AVPR1B
Synonym	AVPR3 Vasopressin V3 receptor vasopressin V1b receptor V3/V1b pituitary vasopressin receptor V3 V1bR V1B receptor Antidiuretic hormone receptor 1b AVPR V1b AVPR V3 VPR3 [ Show all ]
Disease	Anxiety disorder Major depressive disorder; Anxiety Major depressive disorder
Length	424
Amino acid sequence	MDSGPLWDANPTPRGTLSAPNATTPWLGRDEELAKVEIGVLATVLVLATGGNLAVLLTLGQLGRKRSRMHLFVLHLALTDLAVALFQVLPQLLWDITYRFQGPDLLCRAVKYLQVLSMFASTYMLLAMTLDRYLAVCHPLRSLQQPGQSTYLLIAAPWLLAAIFSLPQVFIFSLREVIQGSGVLDCWADFGFPWGPRAYLTWTTLAIFVLPVTMLTACYSLICHEICKNLKVKTQAWRVGGGGWRTWDRPSPSTLAATTRGLPSRVSSINTISRAKIRTVKMTFVIVLAYIACWAPFFSVQMWSVWDKNAPDEDSTNVAFTISMLLGNLNSCCNPWIYMGFNSHLLPRPLRHLACCGGPQPRMRRRLSDGSLSSRHTTLLTRSSCPATLSLSLSLTLSGRPRPEESPRDLELADGEGTAETIIF
UniProt	P47901
Protein Data Bank	N/A
GPCR-HGmod model	P47901
3D structure model	This predicted structure model is from GPCR-EXP P47901.
BioLiP	N/A
Therapeutic Target Database	T59881
ChEMBL	CHEMBL1921
IUPHAR	367
DrugBank	BE0000773

Ligand

Name	MLS000568644
Molecular formula	C20H12O5
IUPAC name	(6-oxobenzo[c]chromen-3-yl) phenyl carbonate
Molecular weight	332.311
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	4.8
Synonyms	MCULE-2107436232 SMR000175478 (6-oxidanylidenebenzo[c]chromen-3-yl) phenyl carbonate carbonic acid (6-oxo-3-benzo[c][1]benzopyranyl) phenyl ester MolPort-001-938-800 ST50031517 AC1LETOM Oprea1_806402 BDBM95306 HMS1553L19 SR-01000404646 (6-oxobenzo[c]chromen-3-yl) phenyl carbonate Carbonic acid 6-oxo-6H-benzo[c]chromen-3-yl ester phenyl ester Opera_ID_1268 TimTec1_006949 AKOS000536691 CHEMBL1404472 HMS2326P10 REGID_for_CID_692203 carbonic acid (6-ketobenzo[c]chromen-3-yl) phenyl ester MLS002536805 SR-01000404646-1 6-oxobenzo[c]chromen-3-yl phenoxyformate CCG-104537 Oprea1_756699 ZINC63677 BAS 00568057 cid_692203 [ Show all ]
Inchi Key	GRZFLTREEADAON-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H12O5/c21-19-17-9-5-4-8-15(17)16-11-10-14(12-18(16)25-19)24-20(22)23-13-6-2-1-3-7-13/h1-12H
PubChem CID	692203
ChEMBL	CHEMBL1404472
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Potency	21810.3 nM	PubChem BioAssay data set	ChEMBL

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