BDBM50296454 5-((1H-indol-3-yl)methylene)-2-(2,4-dichlorophenylamino)thiazol-4(5H)-one::CHEMBL549295::cid_5530131

SMILES: Clc1ccc(NC2=NC(=O)C(S2)=Cc2c[nH]c3ccccc23)c(Cl)c1

InChI Key: InChIKey=OYSYEYPBKTUHFY-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50296454   

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
cysteine protease ATG4B isoform a (Homo sapiens (Human))	BDBM50296454 (5-((1H-indol-3-yl)methylene)-2-(2,4-dichlorophenyl...) Show SMILES Clc1ccc(NC2=NC(=O)C(S2)=Cc2c[nH]c3ccccc23)c(Cl)c1 |w:12.13,t:6| Show InChI InChI=1S/C18H11Cl2N3OS/c19-11-5-6-15(13(20)8-11)22-18-23-17(24)16(25-18)7-10-9-21-14-4-2-1-3-12(10)14/h1-9,21H,(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.64E+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 (2011) BindingDB Entry DOI: 10.7270/Q2BZ64H1
					More data for this Ligand-Target Pair
Phospholipase A2 (Homo sapiens (Human))	BDBM50296454 (5-((1H-indol-3-yl)methylene)-2-(2,4-dichlorophenyl...) Show SMILES Clc1ccc(NC2=NC(=O)C(S2)=Cc2c[nH]c3ccccc23)c(Cl)c1 |w:12.13,t:6| Show InChI InChI=1S/C18H11Cl2N3OS/c19-11-5-6-15(13(20)8-11)22-18-23-17(24)16(25-18)7-10-9-21-14-4-2-1-3-12(10)14/h1-9,21H,(H,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.50E+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 (2011) BindingDB Entry DOI: 10.7270/Q26M35BC
					More data for this Ligand-Target Pair
Dual specificity phosphatase Cdc25B (Homo sapiens (Human))	BDBM50296454 (5-((1H-indol-3-yl)methylene)-2-(2,4-dichlorophenyl...) Show SMILES Clc1ccc(NC2=NC(=O)C(S2)=Cc2c[nH]c3ccccc23)c(Cl)c1 |w:12.13,t:6| Show InChI InChI=1S/C18H11Cl2N3OS/c19-11-5-6-15(13(20)8-11)22-18-23-17(24)16(25-18)7-10-9-21-14-4-2-1-3-12(10)14/h1-9,21H,(H,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sejong University Curated by ChEMBL					Assay Description Inhibition of N-terminal 6xHis-tagged (378-566) catalytic domain of Cdc25B expressed in Escherichia coli after 20 mins by by fluorescent plate reader...				Bioorg Med Chem Lett 19: 4330-4 (2009) Article DOI: 10.1016/j.bmcl.2009.05.084 BindingDB Entry DOI: 10.7270/Q2NZ87P2
					More data for this Ligand-Target Pair
26S Proteasome regulatory subunit Rpn11 (Rpn11) (Homo sapiens (Human))	BDBM50296454 (5-((1H-indol-3-yl)methylene)-2-(2,4-dichlorophenyl...) Show SMILES Clc1ccc(NC2=NC(=O)C(S2)=Cc2c[nH]c3ccccc23)c(Cl)c1 |w:12.13,t:6| Show InChI InChI=1S/C18H11Cl2N3OS/c19-11-5-6-15(13(20)8-11)22-18-23-17(24)16(25-18)7-10-9-21-14-4-2-1-3-12(10)14/h1-9,21H,(H,22,23,24)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.65E+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, La Jolla, CA...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2PC30Z9
					More data for this Ligand-Target Pair
phosphatase Cdc25 (Homo sapiens (Human))	BDBM50296454 (5-((1H-indol-3-yl)methylene)-2-(2,4-dichlorophenyl...) Show SMILES Clc1ccc(NC2=NC(=O)C(S2)=Cc2c[nH]c3ccccc23)c(Cl)c1 |w:12.13,t:6| Show InChI InChI=1S/C18H11Cl2N3OS/c19-11-5-6-15(13(20)8-11)22-18-23-17(24)16(25-18)7-10-9-21-14-4-2-1-3-12(10)14/h1-9,21H,(H,22,23,24)	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sejong University Curated by ChEMBL					Assay Description Inhibition of N-terminal 6xHis-tagged human Cdc25A (336-523) catalytic domain expressed in Escherichia coli after 20 mins by fluorescent plate reader...				Bioorg Med Chem Lett 19: 4330-4 (2009) Article DOI: 10.1016/j.bmcl.2009.05.084 BindingDB Entry DOI: 10.7270/Q2NZ87P2
					More data for this Ligand-Target Pair
Thrombin (Bos taurus (Bovine))	BDBM50296454 (5-((1H-indol-3-yl)methylene)-2-(2,4-dichlorophenyl...) Show SMILES Clc1ccc(NC2=NC(=O)C(S2)=Cc2c[nH]c3ccccc23)c(Cl)c1 |w:12.13,t:6| Show InChI InChI=1S/C18H11Cl2N3OS/c19-11-5-6-15(13(20)8-11)22-18-23-17(24)16(25-18)7-10-9-21-14-4-2-1-3-12(10)14/h1-9,21H,(H,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.83E+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, La Jolla, CA...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2JM286J
					More data for this Ligand-Target Pair