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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	Neuromedin-B receptor
Species	Homo sapiens (Human)
Gene	NMBR
Synonym	BB1 receptor Epididymis tissue protein Li 185a BB1 neuromedin-B-preferring bombesin receptor NMB-R neuromedin B receptor [ Show all ]
Disease	N/A
Length	390
Amino acid sequence	MPSKSLSNLSVTTGANESGSVPEGWERDFLPASDGTTTELVIRCVIPSLYLLIITVGLLGNIMLVKIFITNSAMRSVPNIFISNLAAGDLLLLLTCVPVDASRYFFDEWMFGKVGCKLIPVIQLTSVGVSVFTLTALSADRYRAIVNPMDMQTSGALLRTCVKAMGIWVVSVLLAVPEAVFSEVARISSLDNSSFTACIPYPQTDELHPKIHSVLIFLVYFLIPLAIISIYYYHIAKTLIKSAHNLPGEYNEHTKKQMETRKRLAKIVLVFVGCFIFCWFPNHILYMYRSFNYNEIDPSLGHMIVTLVARVLSFGNSCVNPFALYLLSESFRRHFNSQLCCGRKSYQERGTSYLLSSSAVRMTSLKSNAKNMVTNSVLLNGHSMKQEMAL
UniProt	P28336
Protein Data Bank	N/A
GPCR-HGmod model	P28336
3D structure model	This predicted structure model is from GPCR-EXP P28336.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3636
IUPHAR	38
DrugBank	N/A

Ligand

Name	CHEMBL419174
Molecular formula	C27H26N6O4
IUPAC name	3-[(4-nitrophenyl)carbamoylamino]-N-(2-pyridin-2-ylethyl)-1,2,4,9-tetrahydrocarbazole-3-carboxamide
Molecular weight	498.543
Hydrogen bond acceptor	5
Hydrogen bond donor	4
XlogP	3.4
Synonyms	BDBM50147034 3-[3-(4-Nitro-phenyl)-ureido]-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid (2-pyridin-2-yl-ethyl)-amide
Inchi Key	ASPCKHQVRZRSAQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H26N6O4/c34-25(29-16-13-18-5-3-4-15-28-18)27(32-26(35)30-19-8-10-20(11-9-19)33(36)37)14-12-24-22(17-27)21-6-1-2-7-23(21)31-24/h1-11,15,31H,12-14,16-17H2,(H,29,34)(H2,30,32,35)
PubChem CID	44333720
ChEMBL	CHEMBL419174
IUPHAR	N/A
BindingDB	50147034
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	<10000.0 nM	PMID15149640	BindingDB,ChEMBL

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