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GPCR

NameC-C chemokine receptor type 6
SpeciesHomo sapiens (Human)
GeneCCR6
SynonymDRY6
G-protein coupled receptor 29
GPR-CY4
GPR29
GPRCY4
[ Show all ]
DiseaseN/A
Length374
Amino acid sequenceMSGESMNFSDVFDSSEDYFVSVNTSYYSVDSEMLLCSLQEVRQFSRLFVPIAYSLICVFGLLGNILVVITFAFYKKARSMTDVYLLNMAIADILFVLTLPFWAVSHATGAWVFSNATCKLLKGIYAINFNCGMLLLTCISMDRYIAIVQATKSFRLRSRTLPRSKIICLVVWGLSVIISSSTFVFNQKYNTQGSDVCEPKYQTVSEPIRWKLLMLGLELLFGFFIPLMFMIFCYTFIVKTLVQAQNSKRHKAIRVIIAVVLVFLACQIPHNMVLLVTAANLGKMNRSCQSEKLIGYTKTVTEVLAFLHCCLNPVLYAFIGQKFRNYFLKILKDLWCVRRKYKSSGFSCAGRYSENISRQTSETADNDNASSFTM
UniProtP51684
Protein Data BankN/A
GPCR-HGmod modelP51684
3D structure modelThis predicted structure model is from GPCR-EXP P51684.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4423
IUPHARN/A
DrugBankN/A

Ligand

NameMLS001180103
Molecular formulaC16H15N3O2S
IUPAC nameN-[[(4-methylbenzoyl)amino]carbamothioyl]benzamide
Molecular weight313.375
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP3.5
SynonymsARONIS003396
MCULE-5981029631
N-{[2-(4-methylbenzoyl)hydrazino]carbonothioyl}benzamide
N-({2-[(4-methylphenyl)carbonyl]hydrazinyl}carbonothioyl)benzamide
SMR000477082
[ Show all ]
Inchi KeyFMEMNCREVJAVHG-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H15N3O2S/c1-11-7-9-13(10-8-11)15(21)18-19-16(22)17-14(20)12-5-3-2-4-6-12/h2-10H,1H3,(H,18,21)(H2,17,19,20,22)
PubChem CID1788711
ChEMBLCHEMBL1435343
IUPHARN/A
BindingDB80034
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC5030200.0 nM, PubChem BioAssay data setBindingDB,ChEMBL

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