BDBM50624 MLS000775572::SMR000370463::cid_2545377

SMILES: COc1ccc(O)c(c1)C(=O)c1cc(SCC(O)=O)c2nc3sc4CCCCc4c3c(=O)n2c1

InChI Key: InChIKey=VVQZEWVOOOTEQG-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 50624   

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
streptokinase A precursor (Streptococcus pyogenes M1 GAS)	BDBM50624 (MLS000775572 | SMR000370463 | cid_2545377) Show SMILES COc1ccc(O)c(c1)C(=O)c1cc(SCC(O)=O)c2nc3sc4CCCCc4c3c(=O)n2c1 Show InChI InChI=1S/C24H20N2O6S2/c1-32-13-6-7-16(27)15(9-13)21(30)12-8-18(33-11-19(28)29)22-25-23-20(24(31)26(22)10-12)14-4-2-3-5-17(14)34-23/h6-10,27H,2-5,11H2,1H3,(H,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.64E+4	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2736PBV
					More data for this Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human))	BDBM50624 (MLS000775572 | SMR000370463 | cid_2545377) Show SMILES COc1ccc(O)c(c1)C(=O)c1cc(SCC(O)=O)c2nc3sc4CCCCc4c3c(=O)n2c1 Show InChI InChI=1S/C24H20N2O6S2/c1-32-13-6-7-16(27)15(9-13)21(30)12-8-18(33-11-19(28)29)22-25-23-20(24(31)26(22)10-12)14-4-2-3-5-17(14)34-23/h6-10,27H,2-5,11H2,1H3,(H,28,29)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.49E+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