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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	Motilin receptor
Species	Homo sapiens (Human)
Gene	MLNR
Synonym	GPR38 G protein-coupled receptor 38 G-protein coupled receptor 38 MTLR1 MTLR motilin receptor MOT-R [ Show all ]
Disease	Gastrointestinal disorders; Gastroesophageal reflux disease Irritable bowel syndrome Gastrointestinal disease Gastroesophageal reflux disease Gastric motility disorder Pain Dyspepsia Diarrhea Delayed gastric emptying; Gastroparesis Constipation Gastroparesis [ Show all ]
Length	412
Amino acid sequence	MGSPWNGSDGPEGAREPPWPALPPCDERRCSPFPLGALVPVTAVCLCLFVVGVSGNVVTVMLIGRYRDMRTTTNLYLGSMAVSDLLILLGLPFDLYRLWRSRPWVFGPLLCRLSLYVGEGCTYATLLHMTALSVERYLAICRPLRARVLVTRRRVRALIAVLWAVALLSAGPFLFLVGVEQDPGISVVPGLNGTARIASSPLASSPPLWLSRAPPPSPPSGPETAEAAALFSRECRPSPAQLGALRVMLWVTTAYFFLPFLCLSILYGLIGRELWSSRRPLRGPAASGRERGHRQTVRVLLVVVLAFIICWLPFHVGRIIYINTEDSRMMYFSQYFNIVALQLFYLSASINPILYNLISKKYRAAAFKLLLARKSRPRGFHRSRDTAGEVAGDTGGDTVGYTETSANVKTMG
UniProt	O43193
Protein Data Bank	N/A
GPCR-HGmod model	O43193
3D structure model	This predicted structure model is from GPCR-EXP O43193.
BioLiP	N/A
Therapeutic Target Database	T62306
ChEMBL	CHEMBL2203
IUPHAR	297
DrugBank	BE0003521

Ligand

Name	CHEMBL378317
Molecular formula	C35H38Cl3FN4O5
IUPAC name	4-fluoro-N-[[3-[(3-nitrophenyl)methyl-(2,2,2-trichloroacetyl)amino]cyclohexyl]methyl]-N-[3-(2-pyrrolidin-1-ylethoxy)phenyl]benzamide
Molecular weight	720.06
Hydrogen bond acceptor	7
Hydrogen bond donor	0
XlogP	7.7
Synonyms	BDBM50186102 N-((3-(N-(3-nitrobenzyl)-2,2,2-trichloroacetamido)cyclohexyl)methyl)-4-fluoro-N-(3-(2-(pyrrolidin-1-yl)ethoxy)phenyl)benzamide
Inchi Key	BDLIUAXYTCOMLC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C35H38Cl3FN4O5/c36-35(37,38)34(45)42(24-26-7-4-10-31(21-26)43(46)47)29-8-3-6-25(20-29)23-41(33(44)27-12-14-28(39)15-13-27)30-9-5-11-32(22-30)48-19-18-40-16-1-2-17-40/h4-5,7,9-15,21-22,25,29H,1-3,6,8,16-20,23-24H2
PubChem CID	44412894
ChEMBL	CHEMBL378317
IUPHAR	N/A
BindingDB	50186102
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
IC50	14.0 nM	PMID16650762	BindingDB
IC50	52.0 nM	PMID16650762	BindingDB,ChEMBL
IC50	72.0 nM	PMID16650762	BindingDB

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