BDBM79969 3-[[(2Z)-2-(6-ketocyclohexa-2,4-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]thio]-1-phenyl-pyrrolidine-2,5-quinone::3-[[(2Z)-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]sulfanyl]-1-phenyl-pyrrolidine-2,5-dione::3-[[(2Z)-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-3H-1,3,4-oxadiazol-5-yl]thio]-1-phenylpyrrolidine-2,5-dione::3-[[(2Z)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]sulfanyl]-1-phenylpyrrolidine-2,5-dione::3-{[5-(2-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]thio}-1-phenyl-2,5-pyrrolidinedione::MLS000065124::SMR000078558::cid_5740381

SMILES: Oc1cc(Sc2nnc(o2)-c2ccccc2O)c(O)n1-c1ccccc1

InChI Key: InChIKey=DDZGCYNBRRDCGO-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 79969   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
C-C chemokine receptor type 6 (CCR6) (Homo sapiens (Human))	BDBM79969 (3-[[(2Z)-2-(6-ketocyclohexa-2,4-dien-1-ylidene)-3H...) Show SMILES Oc1cc(Sc2nnc(o2)-c2ccccc2O)c(O)n1-c1ccccc1 Show InChI InChI=1S/C18H13N3O4S/c22-13-9-5-4-8-12(13)16-19-20-18(25-16)26-14-10-15(23)21(17(14)24)11-6-2-1-3-7-11/h1-10,22-24H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	4.22E+4	n/a	n/a	n/a	n/a	n/a	n/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, CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q20P0XHD
					More data for this Ligand-Target Pair
Beta-galactosidase (Escherichia coli)	BDBM79969 (3-[[(2Z)-2-(6-ketocyclohexa-2,4-dien-1-ylidene)-3H...) Show SMILES Oc1cc(Sc2nnc(o2)-c2ccccc2O)c(O)n1-c1ccccc1 Show InChI InChI=1S/C18H13N3O4S/c22-13-9-5-4-8-12(13)16-19-20-18(25-16)26-14-10-15(23)21(17(14)24)11-6-2-1-3-7-11/h1-10,22-24H	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>6.66E+4	n/a	n/a	n/a	n/a	n/a	n/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 (2011) BindingDB Entry DOI: 10.7270/Q2NG4P4X
					More data for this Ligand-Target Pair