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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.
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	Kappa-type opioid receptor
Species	Cavia porcellus (Guinea pig)
Gene	OPRK1
Synonym	K-OR-1 KOR-1
Disease	N/A for non-human GPCRs
Length	380
Amino acid sequence	MGRRRQGPAQPASELPARNACLLPNGSAWLPGWAEPDGNGSAGPQDEQLEPAHISPAIPVIITAVYSVVFVVGLVGNSLVMFVIIRYTKMKTATNIYIFNLALADALVTTTMPFQSTVYLMNSWPFGDVLCKIVISIDYYNMFTSIFTLTMMSVDRYIAVCHPVKALDFRTPLKAKIINICIWLLSSSVGISAIILGGTKVREDVDIIECSLQFPDDDYSWWDLFMKICVFVFAFVIPVLIIIVCYTLMILRLKSVRLLSGSREKDRNLRRITRLVLVVVAVFIICWTPIHIFILVEALGSTSHSTAALSSYYFCIALGYTNSSLNPILYAFLDENFKRCFRDFCFPIKMRMERQSTSRVRNTVQDPAYMRNVDGVNKPV
UniProt	P41144
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	CHEMBL3952
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL1797518
Molecular formula	C63H72N4O9
IUPAC name	None
Molecular weight	1029.29
Hydrogen bond acceptor	13
Hydrogen bond donor	3
XlogP	8.2
Synonyms	BDBM50347164
Inchi Key	AKRUZRBHEYKLPW-PTFQVOMSSA-N
Inchi ID	InChI=1S/C63H72N4O9/c68-43-10-7-34-25-40-37-13-16-61(52-58(37,46(34)49(43)71-52)19-22-64(40)28-31-1-2-31)55-67-56(74-61)62(17-14-38-41-26-35-8-11-44(69)50-47(35)59(38,53(62)72-50)20-23-65(41)29-32-3-4-32)76-57(67)63(75-55)18-15-39-42-27-36-9-12-45(70)51-48(36)60(39,54(63)73-51)21-24-66(42)30-33-5-6-33/h7-12,31-33,37-42,52-57,68-70H,1-6,13-30H2/t37-,38-,39-,40+,41+,42+,52+,53+,54+,55-,56-,57-,58-,59-,60-,61-,62-,63-/m0/s1
PubChem CID	56683403
ChEMBL	CHEMBL1797518
IUPHAR	N/A
BindingDB	50347164
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor. 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
Ki	43.2 nM	PMID21641219	BindingDB,ChEMBL

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