BDBM50359926 CHEMBL1926961

SMILES: CCOC(=O)CCCSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C

InChI Key: InChIKey=IVJITFLZWWSRAH-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 50359926   

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
Protoporphyrinogen oxidase (Homo sapiens (Human))	BDBM50359926 (CHEMBL1926961) Show SMILES CCOC(=O)CCCSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C Show InChI InChI=1S/C19H22FN3O4S2/c1-5-26-15(24)7-6-8-28-17-21-12-10-13(11(20)9-14(12)29-17)23-18(25)27-16(22-23)19(2,3)4/h9-10H,5-8H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	360	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central China Normal University Curated by ChEMBL					Assay Description Inhibition of human PPO by capillary electrophoresis method				Bioorg Med Chem 20: 296-304 (2011) Article DOI: 10.1016/j.bmc.2011.10.079 BindingDB Entry DOI: 10.7270/Q2FJ2H6T
					More data for this Ligand-Target Pair
Protoporphyrinogen oxidase (Homo sapiens (Human))	BDBM50359926 (CHEMBL1926961) Show SMILES CCOC(=O)CCCSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C Show InChI InChI=1S/C19H22FN3O4S2/c1-5-26-15(24)7-6-8-28-17-21-12-10-13(11(20)9-14(12)29-17)23-18(25)27-16(22-23)19(2,3)4/h9-10H,5-8H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central China Normal University Curated by ChEMBL					Assay Description Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...				J Agric Food Chem 58: 2643-51 (2010) Article DOI: 10.1021/jf9026298 BindingDB Entry DOI: 10.7270/Q2ZW1PS7
					More data for this Ligand-Target Pair
Protoporphyrinogen oxidase (Homo sapiens (Human))	BDBM50359926 (CHEMBL1926961) Show SMILES CCOC(=O)CCCSc1nc2cc(c(F)cc2s1)-n1nc(oc1=O)C(C)(C)C Show InChI InChI=1S/C19H22FN3O4S2/c1-5-26-15(24)7-6-8-28-17-21-12-10-13(11(20)9-14(12)29-17)23-18(25)27-16(22-23)19(2,3)4/h9-10H,5-8H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	708	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central China Normal University Curated by ChEMBL					Assay Description Inhibition of Homo sapiens (human) recombinant protoporphyrinogen oxidase expressed in Escherichia coli JM109 assessed as oxidation of protoporphyrin...				J Agric Food Chem 58: 2643-51 (2010) Article DOI: 10.1021/jf9026298 BindingDB Entry DOI: 10.7270/Q2ZW1PS7
					More data for this Ligand-Target Pair