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GLASS

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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	CHEMBL385673
Molecular formula	C32H43N5O4
IUPAC name	(6R,9R,12S)-6-(1H-indol-3-ylmethyl)-9-propan-2-yl-12-propyl-2-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),18,20-triene-7,10,13-trione
Molecular weight	561.727
Hydrogen bond acceptor	5
Hydrogen bond donor	5
XlogP	4.7
Synonyms	BDBM50199346 SCHEMBL75367 (9R,12R,15S)-9-(1H-indol-3-ylmethyl)-12-isopropyl-15-propyl-6,7,8,9,11,12,14,15,17,18,19,20-dodecahydro-5-oxa-8,11,14,17-tetraaza-benzocyclooctadecene-10,13,16-trione
Inchi Key	HXQKKWQVXQUWBQ-YIKNKFAXSA-N
Inchi ID	InChI=1S/C32H43N5O4/c1-4-10-26-30(38)34-16-9-12-22-11-5-8-15-28(22)41-18-17-33-27(31(39)37-29(21(2)3)32(40)36-26)19-23-20-35-25-14-7-6-13-24(23)25/h5-8,11,13-15,20-21,26-27,29,33,35H,4,9-10,12,16-19H2,1-3H3,(H,34,38)(H,36,40)(H,37,39)/t26-,27+,29+/m0/s1
PubChem CID	11192254
ChEMBL	CHEMBL385673
IUPHAR	N/A
BindingDB	50199346
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
Ki	255.0 nM	PMID17125271	BindingDB,ChEMBL

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