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SMILES: [#6]-c1ccc(cc1)-[#6](=O)-[#6](\[#6](=O)\[#6]=[#6]\c1ccccc1)=[#6]-1\[#16]-[#6]-[#6]-[#6]-[#16]-1

InChI Key: InChIKey=XITBDTBJAXNHOO-JLHYYAGUSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 61012   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
G-protein coupled receptor 55


(Homo sapiens (Human))		BDBM61012
PNG
((E)-2-(1,3-dithian-2-ylidene)-1-(4-methylphenyl)-5...)
Show SMILES [#6]-c1ccc(cc1)-[#6](=O)-[#6](\[#6](=O)\[#6]=[#6]\c1ccccc1)=[#6]-1\[#16]-[#6]-[#6]-[#6]-[#16]-1
Show InChI InChI=1S/C22H20O2S2/c1-16-8-11-18(12-9-16)21(24)20(22-25-14-5-15-26-22)19(23)13-10-17-6-3-2-4-7-17/h2-4,6-13H,5,14-15H2,1H3/b13-10+
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 3.63E+3n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GF0RZ3
More data for this
Ligand-Target Pair