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GPCR

Name	Mu-type opioid receptor
Species	Homo sapiens (Human)
Gene	OPRM1
Synonym	hMOP M-OR-1 MOP opioid receptor, mu 1 opioid receptor MOPr MOR-1 Mu opiate receptor Mu opioid receptor mu receptor OP3 [ Show all ]
Disease	Diarrhea Inflammatory disease Pain Major depressive disorder Migraine Mild pain Moderate-to-severe acute pain Opioid-induced constipation Opiate dependence Urinary incontinence Movement disorder Obesity Non-small cell lung cancer Systemic pain Headache Analgesia Anesthesia Asthma Cancer pain Chronic pain Constipation Diabetic neuropathy Unspecified Gastrointestinal disease Gastrointestinal disease; Pain General anesthesia Narcotic depression [ Show all ]
Length	400
Amino acid sequence	MDSSAAPTNASNCTDALAYSSCSPAPSPGSWVNLSHLDGNLSDPCGPNRTDLGGRDSLCPPTGSPSMITAITIMALYSIVCVVGLFGNFLVMYVIVRYTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGTILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDFRTPRNAKIINVCNWILSSAIGLPVMFMATTKYRQGSIDCTLTFSHPTWYWENLLKICVFIFAFIMPVLIITVCYGLMILRLKSVRMLSGSKEKDRNLRRITRMVLVVVAVFIVCWTPIHIYVIIKALVTIPETTFQTVSWHFCIALGYTNSCLNPVLYAFLDENFKRCFREFCIPTSSNIEQQNSTRIRQNTRDHPSTANTVDRTNHQLENLEAETAPLP
UniProt	P35372
Protein Data Bank	N/A
GPCR-HGmod model	P35372
3D structure model	This predicted structure model is from GPCR-EXP P35372.
BioLiP	N/A
Therapeutic Target Database	T47768
ChEMBL	CHEMBL233
IUPHAR	319
DrugBank	BE0000770

Ligand

Name	DSLET
Molecular formula	C33H46N6O10
IUPAC name	(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoic acid
Molecular weight	686.763
Hydrogen bond acceptor	11
Hydrogen bond donor	10
XlogP	-3.0
Synonyms	C33H46N6O10 Enkephalin, Ser(2), Leu(5), Thr(6)- Leu-enkephalin, ser(2)-thr- ZINC27215004 (2S,5S,8S,14R,17S)-17-amino-8-benzyl-2-((R)-1-hydroxyethyl)-14-(hydroxymethyl)-18-(4-hydroxyphenyl)-5-isobutyl-4,7,10,13,16-pentaoxo-3,6,9,12,15-pentaazaoctadecan-1-oic acid AC1Q1O9T D0EM9A FT-0773267 Ser(2)-leu(5)-enkephalin-thr(6) 2-Ser-thr-leu-enkephalin C-54757 DSLET-OH L-Threonine, L-tyrosyl-D-serylglycyl-L-phenylalanyl-L-leucyl- Tyrosyl-seryl-glycyl-phenylalanyl-leucyl-threonine 75644-90-5 Enkephalin-leu, ser(2)-thr- Leucine-enkephalin, ser(2)-thr- [D-Ser2, Leu5, Thr6]-enkephalin (D-Ser2)-Leu-Enkephalin-Thr AKOS024456434 Dislet GTPL1609 Tyr-D-Ser-Gly-Phe-Leu-Thr 2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-3-hydroxy-propionylamino}-acetylamino)-3-phenyl-propionylamino]-4-methyl-pentanoylamino}-3-hydroxy-butyric acid C20165 DSTLE L-Threonine, N-(N-(N-(N-(N-L-tyrosyl-D-seryl)glycyl)-L-phenylalanyl)-L-leucyl)- tyrosyl-seryl-glycyl-phenylalanyl-leucyl-threonine, (L-Thr-D-Tyr-L-Ser-L-Phe-L-Leu)-isomer (2S,3R)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoic acid AC1L32UT CHEMBL124283 Enkephalin-leu, seryl(2)-threonine- LS-177202 [D-Ser2,Leu5]Enkephalin-Thr6 BDBM50018708 H-Tyr-D-Ser-Gly-Phe-Leu-Thr-OH Tyr-ser-gly-phe-leu-thr [ Show all ]
Inchi Key	PKSODCLCMBUCPW-LVNBQDLPSA-N
Inchi ID	InChI=1S/C33H46N6O10/c1-18(2)13-24(32(47)39-28(19(3)41)33(48)49)37-31(46)25(15-20-7-5-4-6-8-20)36-27(43)16-35-30(45)26(17-40)38-29(44)23(34)14-21-9-11-22(42)12-10-21/h4-12,18-19,23-26,28,40-42H,13-17,34H2,1-3H3,(H,35,45)(H,36,43)(H,37,46)(H,38,44)(H,39,47)(H,48,49)/t19-,23+,24+,25+,26-,28+/m1/s1
PubChem CID	107847
ChEMBL	CHEMBL124283
IUPHAR	1609
BindingDB	50018708
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
Ki	6.30957 nM	PMID9686407	IUPHAR
Ki	6.9 nM	PMID9686407	BindingDB
Ki	13.83 nM	PMID7932177	BindingDB
Ki	39.0 nM	PMID8114680	BindingDB

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