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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	C-C chemokine receptor type 6
Species	Homo sapiens (Human)
Gene	CCR6
Synonym	DRY6 G-protein coupled receptor 29 GPR-CY4 GPR29 GPRCY4 LARC receptor DRY-6 DCCR2 CKR-L3 Chemokine receptor-like 3 CD196 CCR6 CCR-6 CC-CKR-6 C-C CKR-6 STRL22 [ Show all ]
Disease	N/A
Length	374
Amino acid sequence	MSGESMNFSDVFDSSEDYFVSVNTSYYSVDSEMLLCSLQEVRQFSRLFVPIAYSLICVFGLLGNILVVITFAFYKKARSMTDVYLLNMAIADILFVLTLPFWAVSHATGAWVFSNATCKLLKGIYAINFNCGMLLLTCISMDRYIAIVQATKSFRLRSRTLPRSKIICLVVWGLSVIISSSTFVFNQKYNTQGSDVCEPKYQTVSEPIRWKLLMLGLELLFGFFIPLMFMIFCYTFIVKTLVQAQNSKRHKAIRVIIAVVLVFLACQIPHNMVLLVTAANLGKMNRSCQSEKLIGYTKTVTEVLAFLHCCLNPVLYAFIGQKFRNYFLKILKDLWCVRRKYKSSGFSCAGRYSENISRQTSETADNDNASSFTM
UniProt	P51684
Protein Data Bank	N/A
GPCR-HGmod model	P51684
3D structure model	This predicted structure model is from GPCR-EXP P51684.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4423
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	2-Bromo-3,4,5-triphenyl-2,4-cyclopentadien-1-one
Molecular formula	C23H15BrO
IUPAC name	2-bromo-3,4,5-triphenylcyclopenta-2,4-dien-1-one
Molecular weight	387.276
Hydrogen bond acceptor	1
Hydrogen bond donor	0
XlogP	5.7
Synonyms	CTK5D8023 ZINC1617990 AKOS024406011 NCI60_007646 2-bromo-3,4,5-triphenyl-1-cyclopenta-2,4-dienone CHEMBL1730238 NSC624982 2-bromo-3,4,5-triphenylcyclopenta-2,4-dien-1-one AC1L7J9K MCULE-7621782919 2, 2-bromo-3,4,5-triphenyl- BDBM80070 NSC 624982 cid_361740 SMR001565220 73442-55-4 AC1Q6IOR MLS002701619 2-bromanyl-3,4,5-triphenyl-cyclopenta-2,4-dien-1-one NSC-624982 2-bromo-3,4,5-triphenyl-cyclopenta-2,4-dien-1-one [ Show all ]
Inchi Key	DBJSHCMPSZHIQH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H15BrO/c24-22-20(17-12-6-2-7-13-17)19(16-10-4-1-5-11-16)21(23(22)25)18-14-8-3-9-15-18/h1-15H
PubChem CID	361740
ChEMBL	CHEMBL1730238
IUPHAR	N/A
BindingDB	80070
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
IC50	<66600.0 nM	, PubChem BioAssay data set	BindingDB,ChEMBL

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