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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	C-C chemokine receptor type 10
Species	Homo sapiens (Human)
Gene	CCR10
Synonym	CCR-10 CCR10 CC-CKR-10 G-protein coupled receptor 2 GPR-2 C-C CKR-10 [ Show all ]
Disease	Inflammatory disease
Length	362
Amino acid sequence	MGTEATEQVSWGHYSGDEEDAYSAEPLPELCYKADVQAFSRAFQPSVSLTVAALGLAGNGLVLATHLAARRAARSPTSAHLLQLALADLLLALTLPFAAAGALQGWSLGSATCRTISGLYSASFHAGFLFLACISADRYVAIARALPAGPRPSTPGRAHLVSVIVWLLSLLLALPALLFSQDGQREGQRRCRLIFPEGLTQTVKGASAVAQVALGFALPLGVMVACYALLGRTLLAARGPERRRALRVVVALVAAFVVLQLPYSLALLLDTADLLAARERSCPASKRKDVALLVTSGLALARCGLNPVLYAFLGLRFRQDLRRLLRGGSCPSGPQPRRGCPRRPRLSSCSAPTETHSLSWDN
UniProt	P46092
Protein Data Bank	N/A
GPCR-HGmod model	P46092
3D structure model	This predicted structure model is from GPCR-EXP P46092.
BioLiP	N/A
Therapeutic Target Database	T71054
ChEMBL	CHEMBL2321628
IUPHAR	67
DrugBank	N/A

Ligand

Name	CHEMBL3951018
Molecular formula	C21H25Cl2N5O3S
IUPAC name	4-amino-3,5-dichloro-N-[4-(2-cyanopyrrol-1-yl)-1-(4-methylpiperidin-1-yl)-1-oxobutan-2-yl]benzenesulfonamide
Molecular weight	498.423
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	3.1
Synonyms	BDBM50198920 SCHEMBL1036899
Inchi Key	ZYSPBBJRIQHKDF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H25Cl2N5O3S/c1-14-4-8-28(9-5-14)21(29)19(6-10-27-7-2-3-15(27)13-24)26-32(30,31)16-11-17(22)20(25)18(23)12-16/h2-3,7,11-12,14,19,26H,4-6,8-10,25H2,1H3
PubChem CID	58509213
ChEMBL	CHEMBL3951018
IUPHAR	N/A
BindingDB	50198920
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	1.995 nM	PMID27692854	ChEMBL
IC50	3.162 nM	PMID27692854	ChEMBL
IC50	3.4 nM	PMID27692854	ChEMBL
IC50	12.59 nM	PMID27692854	ChEMBL
IC50	15.85 nM	PMID27692854	ChEMBL
IC50	19.95 nM	PMID27692854	ChEMBL
IC50	158.49 nM	PMID27692854	ChEMBL

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