BDBM261608 US10513499, Compound 19::US9708272, 19

SMILES: O=c1[nH]c(no1)-c1cccc(CSc2nc(-c3cccs3)c(C#N)c(=O)[nH]2)c1

InChI Key: InChIKey=OQVQBVGFAVHLIX-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 = 261608   

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
2-amino-3-carboxymuconate-6-semialdehyde decarboxylase (Homo sapiens (Human))	BDBM261608 (US10513499, Compound 19 | US9708272, 19) Show SMILES O=c1[nH]c(no1)-c1cccc(CSc2nc(-c3cccs3)c(C#N)c(=O)[nH]2)c1 Show InChI InChI=1S/C18H11N5O3S2/c19-8-12-14(13-5-2-6-27-13)20-17(22-16(12)24)28-9-10-3-1-4-11(7-10)15-21-18(25)26-23-15/h1-7H,9H2,(H,20,22,24)(H,21,23,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
TES Pharma S.r.l. US Patent					Assay Description The pre-assay mixture consisting of 3-hydroxyanthranilic acid (30H-HA), 3-hydroxyanthranilic acid, 3,4-diOxygenase (HAO), and a dialyzed crude extrac...				US Patent US10513499 (2019) BindingDB Entry DOI: 10.7270/Q2H41TTQ
					More data for this Ligand-Target Pair
2-amino-3-carboxymuconate-6-semialdehyde decarboxylase (Homo sapiens (Human))	BDBM261608 (US10513499, Compound 19 | US9708272, 19) Show SMILES O=c1[nH]c(no1)-c1cccc(CSc2nc(-c3cccs3)c(C#N)c(=O)[nH]2)c1 Show InChI InChI=1S/C18H11N5O3S2/c19-8-12-14(13-5-2-6-27-13)20-17(22-16(12)24)28-9-10-3-1-4-11(7-10)15-21-18(25)26-23-15/h1-7H,9H2,(H,20,22,24)(H,21,23,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
TES Pharma S.r.l. US Patent					Assay Description The pre-assay mixture consisting of 3-hydroxyanthranilic acid (3OH-HA), 3-hydroxyanthranilic acid, 3,4-diOxygenase (HAO), and a dialyzed crude extrac...				US Patent US9708272 (2017) BindingDB Entry DOI: 10.7270/Q20P1215
					More data for this Ligand-Target Pair