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GPCR

Name	Metabotropic glutamate receptor 5
Species	Rattus norvegicus (Rat)
Gene	Grm5
Synonym	glutamate receptor GPRC1E mGlu5 receptor mGluR5
Disease	N/A for non-human GPCRs
Length	1203
Amino acid sequence	MVLLLILSVLLLKEDVRGSAQSSERRVVAHMPGDIIIGALFSVHHQPTVDKVHERKCGAVREQYGIQRVEAMLHTLERINSDPTLLPNITLGCEIRDSCWHSAVALEQSIEFIRDSLISSEEEEGLVRCVDGSSSFRSKKPIVGVIGPGSSSVAIQVQNLLQLFNIPQIAYSATSMDLSDKTLFKYFMRVVPSDAQQARAMVDIVKRYNWTYVSAVHTEGNYGESGMEAFKDMSAKEGICIAHSYKIYSNAGEQSFDKLLKKLRSHLPKARVVACFCEGMTVRGLLMAMRRLGLAGEFLLLGSDGWADRYDVTDGYQREAVGGITIKLQSPDVKWFDDYYLKLRPETNLRNPWFQEFWQHRFQCRLEGFAQENSKYNKTCNSSLTLRTHHVQDSKMGFVINAIYSMAYGLHNMQMSLCPGYAGLCDAMKPIDGRKLLDSLMKTNFTGVSGDMILFDENGDSPGRYEIMNFKEMGKDYFDYINVGSWDNGELKMDDDEVWSKKNNIIRSVCSEPCEKGQIKVIRKGEVSCCWTCTPCKENEYVFDEYTCKACQLGSWPTDDLTGCDLIPVQYLRWGDPEPIAAVVFACLGLLATLFVTVIFIIYRDTPVVKSSSRELCYIILAGICLGYLCTFCLIAKPKQIYCYLQRIGIGLSPAMSYSALVTKTNRIARILAGSKKKICTKKPRFMSACAQLVIAFILICIQLGIIVALFIMEPPDIMHDYPSIREVYLICNTTNLGVVTPLGYNGLLILSCTFYAFKTRNVPANFNEAKYIAFTMYTTCIIWLAFVPIYFGSNYKIITMCFSVSLSATVALGCMFVPKVYIILAKPERNVRSAFTTSTVVRMHVGDGKSSSAASRSSSLVNLWKRRGSSGETLRYKDRRLAQHKSEIECFTPKGSMGNGGRATMSSSNGKSVTWAQNEKSTRGQHLWQRLSVHINKKENPNQTAVIKPFPKSTENRGPGAAAGGGSGPGVAGAGNAGCTATGGPEPPDAGPKALYDVAEAEESFPAAARPRSPSPISTLSHLAGSAGRTDDDAPSLHSETAARSSSSQGSLMEQISSVVTRFTANISELNSMMLSTAATPGPPGTPICSSYLIPKEIQLPTTMTTFAEIQPLPAIEVTGGAQGATGVSPAQETPTGAESAPGKPDLEELVALTPPSPFRDSVDSGSTTPNSPVSESALCIPSSPKYDTLIIRDYTQSSSSL
UniProt	P31424
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	CHEMBL2564
IUPHAR	293
DrugBank	N/A

Ligand

Name	MPEP
Molecular formula	C14H11N
IUPAC name	2-methyl-6-(2-phenylethynyl)pyridine
Molecular weight	193.249
Hydrogen bond acceptor	1
Hydrogen bond donor	0
XlogP	3.3
Synonyms	7VC0YVI27Y BRD-K60690191-003-02-1 DB-014655 Lopac-M-5435 NCGC00015682-03 s2809 ZX-AN014840 2-Methyl-6-(phenylethynyl)pyridine 2-Picoline, 6-phenylethynyl- AC1MHGB1 GTPL1426 MLS006011229 NCGC00025044-01 SW219533-1 6-methyl-2-(2-phenylethynyl)pyridine BCP05962 D0IO8J KB-78955 NCGC00015682-01 Pyridine, 2-methyl-6-(2-phenylethynyl)- Y0463 2-methyl-6-(phenyl-ethynyl)pyridine 2-Methyl-6-phenylethynyl-pyridine 96206-92-7 CCG-204823 DTXSID9043982 Lopac0_000738 NCGC00015682-04 SCHEMBL103061 [3H]-2-methyl-6-(phenylethynyl)-pyridine 2151AH AKOS006275850 CHEMBL66654 HMS3651F13 MolPort-003-958-770 NCGC00025044-02 Tocris-1212 6-Methyl-2-(phenylethynyl)pyridine BDBM50084137 D0R8TZ L000408 NCGC00015682-02 Pyridine, 2-methyl-6-(phenylethynyl)- ZINC2581406 2-methyl-6-(phenylethynyl)-pyridine 2-Methyl-6-phenylethynyl-pyridine(MPEP) AB0035962 CHEBI:64159 F2167-5303 LS-131827 NCGC00015682-05 SMR004702989 AM81262 CS-0794 HY-14609A NCGC00025044-03 UNII-7VC0YVI27Y 2-methyl-6-(2-phenylethynyl)pyridine [ Show all ]
Inchi Key	NEWKHUASLBMWRE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H11N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-9H,1H3
PubChem CID	3025961
ChEMBL	CHEMBL66654
IUPHAR	1426
BindingDB	50084137
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
ED50	2.1 mg.kg-1	PMID12519057	ChEMBL
ED50	5.0 mg.kg-1	PMID15225713	ChEMBL
IC50	0.2 nM	PMID17590335	BindingDB,ChEMBL
IC50	2.93 nM	PMID21546249	BindingDB,ChEMBL
IC50	3.5 nM	PMID21295978, PMID19445453	BindingDB
IC50	3.54 nM	PMID21295978, PMID19445453	ChEMBL
IC50	13.0 nM	PMID16678408	BindingDB,ChEMBL
IC50	20.0 nM	PMID12565928	BindingDB,ChEMBL
IC50	31.0 nM	PMID22924094	BindingDB,ChEMBL
IC50	36.0 nM	PMID15686891	BindingDB,ChEMBL
IC50	89.0 nM	MedChemComm, (2014) 5:10:1548	ChEMBL
Ki	0.3 nM	PMID12757844	BindingDB
Ki	3.1 nM	PMID16040814	BindingDB
Ki	4.7 nM	PMID19854049	BindingDB,ChEMBL
Ki	5.7 nM	PMID17590335	BindingDB,ChEMBL
Ki	8.7 nM	PMID16040814	BindingDB
Ki	12.0 nM	PMID12519057, PMID18173231	BindingDB,ChEMBL
Ki	13.0 nM	PMID21295978	BindingDB,ChEMBL
Ki	15.0 nM	PMID26014480, PMID12438526	BindingDB
Ki	15.3 nM	PMID26014480	ChEMBL
Ki	16.3 nM	PMID22924094	BindingDB,ChEMBL
Ki	18.7 nM	PMID21546249	BindingDB,ChEMBL
Ki	19.0 nM	PMID17110115	BindingDB,ChEMBL
Ki	20.0 nM	PMID17446071	BindingDB,ChEMBL
Ki	21.0 nM	PMID17336520	BindingDB,ChEMBL

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