Drug General Information
Drug ID	D0K5QW
Former ID	DNC000762
Drug Name	I-309
Drug Type	Small molecular drug
Indication	Discovery agent		Investigative	[542979]
Structure		Download 2D MOL 3D MOL
Formula	C12H8Br2O2S
Canonical SMILES	C1=CC(=CC=C1S(=O)(=O)C2=CC=C(C=C2)Br)Br
InChI	1S/C12H8Br2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H
InChIKey	QBNABJXQGRVIRA-UHFFFAOYSA-N
CAS Number	CAS 26305-03-3
PubChem Compound ID	95927
PubChem Substance ID	97540, 593379, 607733, 1252931, 3301188, 5471014, 10227705, 10512990, 11347370, 14877682, 44426413, 48035568, 48651474, 50048893, 57968492, 77350802, 87772727, 92249723, 99246264, 104416865, 107076083, 117387606, 117931206, 126691837, 128998972, 131304634, 135052194, 140676253, 143490672, 152241300, 162178014, 163410854, 169977273, 179094727, 184583608, 223468789, 223532975, 223663682, 225159313, 226599548, 250077821, 252346079
Target and Pathway
Target(s)	C-C chemokine receptor type 8	Target Info	Binder	[538110]
KEGG Pathway	Cytokine-cytokine receptor interaction
	Chemokine signaling pathway
	Viral carcinogenesis
NetPath Pathway	IL2 Signaling Pathway
PANTHER Pathway	Inflammation mediated by chemokine and cytokine signaling pathway
Reactome	Chemokine receptors bind chemokines
	G alpha (i) signalling events
WikiPathways	GPCRs, Class A Rhodopsin-like
	Peptide GPCRs
	GPCR ligand binding
	GPCR downstream signaling
References
Ref 542979	(http://www.guidetopharmacology.org/) Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 812).
Ref 538110	The chemokine receptor CCR8 is preferentially expressed in Th2 but not Th1 cells. J Immunol. 1998 Jul 15;161(2):547-51.

If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.