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GPCR

Name	5-hydroxytryptamine receptor 2C
Species	Homo sapiens (Human)
Gene	HTR2C
Synonym	Serotonin receptor 2C serotonin 1c receptor 5-HT1C 5-HT2C 5-HT-2C 5-HT2C receptor 5-HTR2C 5-hydroxytryptamine (serotonin) receptor 2C, G protein-coupled 5-hydroxytryptamine receptor 1C HTR1C 5-HT-1C [ Show all ]
Disease	Pain Sleep initiation and maintenance disorders; Primary insomnia; Schizophrenia Unspecified Depression Drug abuse Generalized anxiety disorder; Major depressive disorder Major depressive disorder Metabolic disorders Psychotic disorders Mood disorder Neurological disease Obesity Obesity; Diabetes Migraine headaches Anxiety disorder Alcohol use disorders Aggressive non-hodgkin's lymphoma [ Show all ]
Length	458
Amino acid sequence	MVNLRNAVHSFLVHLIGLLVWQCDISVSPVAAIVTDIFNTSDGGRFKFPDGVQNWPALSIVIIIIMTIGGNILVIMAVSMEKKLHNATNYFLMSLAIADMLVGLLVMPLSLLAILYDYVWPLPRYLCPVWISLDVLFSTASIMHLCAISLDRYVAIRNPIEHSRFNSRTKAIMKIAIVWAISIGVSVPIPVIGLRDEEKVFVNNTTCVLNDPNFVLIGSFVAFFIPLTIMVITYCLTIYVLRRQALMLLHGHTEEPPGLSLDFLKCCKRNTAEEENSANPNQDQNARRRKKKERRPRGTMQAINNERKASKVLGIVFFVFLIMWCPFFITNILSVLCEKSCNQKLMEKLLNVFVWIGYVCSGINPLVYTLFNKIYRRAFSNYLRCNYKVEKKPPVRQIPRVAATALSGRELNVNIYRHTNEPVIEKASDNEPGIEMQVENLELPVNPSSVVSERISSV
UniProt	P28335
Protein Data Bank	6bqg, 6bqh
GPCR-HGmod model	P28335
3D structure model	This structure is from PDB ID 6bqg.
BioLiP	BL0404805, BL0404806
Therapeutic Target Database	T83813
ChEMBL	CHEMBL225
IUPHAR	8
DrugBank	BE0004957, BE0004881, BE0000533

Ligand

Name	792173-99-0
Molecular formula	C17H13N5O2
IUPAC name	1-(2-methyl-1,3-benzoxazol-6-yl)-3-(1,5-naphthyridin-4-yl)urea
Molecular weight	319.324
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	2.0
Synonyms	AKOS005146031 EX-A444 MolPort-003-983-831 SB-334867 SB334867 free base Urea,N-(2-methyl-6-benzoxazolyl)-N'-1,5-naphthyridin-4-yl- 1-(2-methylbenzoxazole-6-yl)-3-[1,5]naphthyridine-4-yl urea BCP28004 CS-2748 HMS3268O14 NCGC00025327-01 SB-334867(freebase) SCHEMBL496853 ZINC8794 ACM249889643 AK-31955 BRD-K41567364-001-01-2 DB-025472 KB-309133 SB 334867 SB19535 TC-063044 1-(2-methyl-1,3-benzoxazol-6-yl)-3-(1,5-naphthyridin-4-yl)urea 4CA-1139 AX8141048 CHEMBL291536 FT-0704742 N-(2-METHYL-6-BENZOXAZOLYL)-N'-1,5-NAPHTHYRIDIN-4-YL UREA SB-334867 (free base) SB334867/SB-334867 Urea,N-(2-methyl-6-benzoxazolyl)-N'-1,5-naphthyridin-4-yl-, hydrochloride (1:1) 1-(2-Methylbenzo[d]oxazol-6-yl)-1-(1,5-naphthyridin-4-yl)urea A15814 BDBM50384416 CTK5E6591 HY-10895A QC-11750 SB-334867, >=98% (HPLC) SR-01000597554 249889-64-3 ACT06542 AKMNUCBQGHFICM-UHFFFAOYSA-N CHEBI:92733 EX-8460 KS-00001CTT SB-334,867 SB334867 Tocris-1960 1-(2-Methyl-benzooxazol-6-yl)-3-[1,5]naphthyridin-4-yl-urea BC280348 CM-2153 GTPL1703 N-(2-methyl-6-benzoxazolyl)-N'-1,5-naphthyridin-4-yl-Urea SB-334867 free base SB334867A ZB000673 1-(2-methylbenzo[d]oxazol-6-yl)-3-(1,5-naphthyridin-4-yl)urea AC1O7H28 BN0630 D0UZ4J I06-2256 s7585 SB-334867A SR-01000597554-1 3013AH AJ-08317 [ Show all ]
Inchi Key	AKMNUCBQGHFICM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H13N5O2/c1-10-20-12-5-4-11(9-15(12)24-10)21-17(23)22-14-6-8-18-13-3-2-7-19-16(13)14/h2-9H,1H3,(H2,18,21,22,23)
PubChem CID	6604926
ChEMBL	CHEMBL291536
IUPHAR	1703
BindingDB	50384416
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	>5011.87 nM	PMID11459658	ChEMBL
Ki	>5012.0 nM	PMID11459658	BindingDB

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