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GPCR

Name5-hydroxytryptamine receptor 2C
SpeciesHomo sapiens (Human)
GeneHTR2C
SynonymSerotonin receptor 2C
serotonin 1c receptor
5-HT1C
5-HT2C
5-HT-2C
[ Show all ]
DiseasePain
Sleep initiation and maintenance disorders; Primary insomnia; Schizophrenia
Unspecified
Depression
Drug abuse
[ Show all ]
Length458
Amino acid sequenceMVNLRNAVHSFLVHLIGLLVWQCDISVSPVAAIVTDIFNTSDGGRFKFPDGVQNWPALSIVIIIIMTIGGNILVIMAVSMEKKLHNATNYFLMSLAIADMLVGLLVMPLSLLAILYDYVWPLPRYLCPVWISLDVLFSTASIMHLCAISLDRYVAIRNPIEHSRFNSRTKAIMKIAIVWAISIGVSVPIPVIGLRDEEKVFVNNTTCVLNDPNFVLIGSFVAFFIPLTIMVITYCLTIYVLRRQALMLLHGHTEEPPGLSLDFLKCCKRNTAEEENSANPNQDQNARRRKKKERRPRGTMQAINNERKASKVLGIVFFVFLIMWCPFFITNILSVLCEKSCNQKLMEKLLNVFVWIGYVCSGINPLVYTLFNKIYRRAFSNYLRCNYKVEKKPPVRQIPRVAATALSGRELNVNIYRHTNEPVIEKASDNEPGIEMQVENLELPVNPSSVVSERISSV
UniProtP28335
Protein Data Bank6bqg, 6bqh
GPCR-HGmod modelP28335
3D structure modelThis structure is from PDB ID 6bqg.
BioLiPBL0404805, BL0404806
Therapeutic Target DatabaseT83813
ChEMBLCHEMBL225
IUPHAR8
DrugBankBE0004957, BE0004881, BE0000533

Ligand

NameCHEMBL52912
Molecular formulaC16H20N4
IUPAC name2-[5-(imidazol-1-ylmethyl)-1H-indol-3-yl]-N,N-dimethylethanamine
Molecular weight268.364
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP1.7
SynonymsN,N-Dimethyl-5-(1H-imidazol-1-ylmethyl)-1H-indole-3-(ethanamine)
SCHEMBL6943873
BDBM50407357
Inchi KeyGXDRKMVYBOOCOD-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H20N4/c1-19(2)7-5-14-10-18-16-4-3-13(9-15(14)16)11-20-8-6-17-12-20/h3-4,6,8-10,12,18H,5,7,11H2,1-2H3
PubChem CID10400849
ChEMBLCHEMBL52912
IUPHARN/A
BindingDB50407357
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
IC503981.07 nMPMID7752204BindingDB,ChEMBL

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