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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.
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GPCR

Name	B2 bradykinin receptor
Species	Oryctolagus cuniculus (Rabbit)
Gene	BDKRB2
Synonym	B2R BK-2 receptor
Disease	N/A for non-human GPCRs
Length	367
Amino acid sequence	MLNITSQVLAPALNGSVSQSSGCPNTEWSGWLNVIQAPFLWVLFVLATLENLFVLSVFCLHKSSCTVAEVYLGNLAAADLILACGLPFWAVTIANHFDWLFGEALCRVVNTMIYMNLYSSICFLMLVSIDRYLALVKTMSIGRMRRVRWAKLYSLVIWGCTLLLSSPMLVFRTMKDYRDEGYNVTACIIDYPSRSWEVFTNVLLNLVGFLLPLSVITFCTVQILQVLRNNEMQKFKEIQTERRATVLVLAVLLLFVVCWLPFQVSTFLDTLLKLGVLSSCWDEHVIDVITQVGSFMGYSNSCLNPLVYVIVGKRFRKKSREVYRAACPKAGCVLEPVQAESSMGTLRTSISVERQIHKLPEWTRSSQ
UniProt	Q28642
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	CHEMBL3453
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL2369364
Molecular formula	C38H55N11O6S
IUPAC name	(2S)-2-[[(2S)-1-[(3S)-2-[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-thiophen-2-ylpropanoyl]-3,4-dihydro-1H-isoquinoline-3-carbonyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Molecular weight	793.989
Hydrogen bond acceptor	10
Hydrogen bond donor	8
XlogP	-2.1
Synonyms	BDBM50407811
Inchi Key	IYLGSJULQPVTHE-MGZZYCNSSA-N
Inchi ID	InChI=1S/C38H55N11O6S/c39-26(12-5-15-44-37(40)41)32(50)47-28(20-25-11-7-17-56-25)34(52)48-21-24-10-2-1-8-22(24)18-31(48)35(53)49-29-14-4-3-9-23(29)19-30(49)33(51)46-27(36(54)55)13-6-16-45-38(42)43/h1-2,7-8,10-11,17,23,26-31H,3-6,9,12-16,18-21,39H2,(H,46,51)(H,47,50)(H,54,55)(H4,40,41,44)(H4,42,43,45)/t23?,26-,27-,28-,29?,30-,31-/m0/s1
PubChem CID	73345363
ChEMBL	CHEMBL2369364
IUPHAR	N/A
BindingDB	50407811
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
Kd	794.33 nM	PMID8642569	BindingDB,ChEMBL

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