null

SMILES: COc1ccc(C=c2c(=CSc3ccc(Cl)cc3)[nH]n(-c3nc4ccccc4s3)c2=O)cc1

InChI Key: InChIKey=IVDGNZBDMVXNJN-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50176   

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
DNA (cytosine-5)-methyltransferase 1 (Homo sapiens (Human))	BDBM50176 ((4E)-2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)...) Show SMILES COc1ccc(C=c2c(=CSc3ccc(Cl)cc3)[nH]n(-c3nc4ccccc4s3)c2=O)cc1 |w:9.9| Show InChI InChI=1S/C25H18ClN3O2S2/c1-31-18-10-6-16(7-11-18)14-20-22(15-32-19-12-8-17(26)9-13-19)28-29(24(20)30)25-27-21-4-2-3-5-23(21)33-25/h2-15,28H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.86E+3	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 (2012) BindingDB Entry DOI: 10.7270/Q2NC5ZRN
					More data for this Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human))	BDBM50176 ((4E)-2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)...) Show SMILES COc1ccc(C=c2c(=CSc3ccc(Cl)cc3)[nH]n(-c3nc4ccccc4s3)c2=O)cc1 |w:9.9| Show InChI InChI=1S/C25H18ClN3O2S2/c1-31-18-10-6-16(7-11-18)14-20-22(15-32-19-12-8-17(26)9-13-19)28-29(24(20)30)25-27-21-4-2-3-5-23(21)33-25/h2-15,28H,1H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q23X8539
					More data for this Ligand-Target Pair