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GLASS

You can:

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.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Mu-type opioid receptor
Species	Cavia porcellus (Guinea pig)
Gene	OPRM1
Synonym	M-OR-1 MOR-1
Disease	N/A for non-human GPCRs
Length	98
Amino acid sequence	YTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGTILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDFRTPRNAKTVNVCNWI
UniProt	P97266
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	CHEMBL4354
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	Deltorphin I
Molecular formula	C37H52N8O10
IUPAC name	(3S)-3-[[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]-4-[[(2S)-1-[[(2S)-1-[(2-amino-2-oxoethyl)amino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid
Molecular weight	768.869
Hydrogen bond acceptor	11
Hydrogen bond donor	10
XlogP	-1.7
Synonyms	CHEMBL317956 HY-P1336 ZINC95610551 MolPort-016-581-002 BDBM50001468 CHEBI:81500 FT-0700737 Tyr-D-Ala-Phe-Asp-Val-Val-Gly-NH2 122752-15-2 CS-0029459 J-004850 AKOS024458238 DELTORPHINI NCGC00167304-01 (S)-3-((S)-2-{(R)-2-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-propionylamino}-3-phenyl-propionylamino)-N-{(S)-1-[(S)-1-(carbamoylmethyl-carbamoyl)-2-methyl-propylcarbamoyl]-2-methyl-propyl}-succinamic acid C-54171 H-Tyr-D-Ala-Phe-Asp-Val-Val-Gly-NH2 Tyr-D-Ala-Phe-Asp-Val-Val-GlyNH2 3-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-propionylamino}-3-phenyl-propionylamino)-N-{1-[1-(carbamoylmethyl-carbamoyl)-2-methyl-propylcarbamoyl]-2-methyl-propyl}-succinamic acid Deltorphin C LS-72216 B5649 C18097 DTXSID10153692 Tyr-d-Ala-Phe-Asp-Val-Val-Gly-NH(2) (S)-4-((S)-1-((S)-1-(2-amino-2-oxoethylamino)-3-methyl-1-oxobutan-2-ylamino)-3-methyl-1-oxobutan-2-ylamino)-3-((S)-2-((R)-2-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)propanamido)-3-phenylpropanamido)-4-oxobutanoic acid [ Show all ]
Inchi Key	CJAORFIPPWIGPG-QXYJMILXSA-N
Inchi ID	InChI=1S/C37H52N8O10/c1-19(2)30(36(54)40-18-28(39)47)45-37(55)31(20(3)4)44-35(53)27(17-29(48)49)43-34(52)26(16-22-9-7-6-8-10-22)42-32(50)21(5)41-33(51)25(38)15-23-11-13-24(46)14-12-23/h6-14,19-21,25-27,30-31,46H,15-18,38H2,1-5H3,(H2,39,47)(H,40,54)(H,41,51)(H,42,50)(H,43,52)(H,44,53)(H,45,55)(H,48,49)/t21-,25+,26+,27+,30+,31+/m1/s1
PubChem CID	10055958
ChEMBL	CHEMBL317956
IUPHAR	N/A
BindingDB	50001468
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
IC50	<1500.0 nM	PMID8289188	BindingDB,ChEMBL
IC50	2.89 nM	Bioorg. Med. Chem. Lett., (1992) 2:6:547	ChEMBL
IC50	2.9 nM	N/A	BindingDB
IC50	337.0 nM	PMID8576920	BindingDB,ChEMBL
IC50	420.0 nM	PMID9258365	BindingDB,ChEMBL
IC50	854.0 nM	PMID1331451	BindingDB,ChEMBL
IC50	1300.0 nM	PMID16366592	BindingDB,ChEMBL
IC50	2890.0 nM	PMID8289187	BindingDB,ChEMBL
IC50	3180.0 nM	PMID8289187	ChEMBL
IC50	5437.0 nM	PMID11958984	BindingDB,ChEMBL
IC50	15000.0 nM	PMID9057856	BindingDB,ChEMBL
Ki	677.0 nM	PMID7707326	BindingDB,ChEMBL
Relative potency	0.288 -	PMID1331451	ChEMBL

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