BDBM50204649 CHEMBL3936539

SMILES: NC(=O)c1cc(ccc1O)-c1cn2cc(I)ccc2n1

InChI Key: InChIKey=QKFQJTRABAAEKS-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50204649   

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
Dual-specificity tyrosine-phosphorylation regulated kinase 1A (Homo sapiens (Human))	BDBM50204649 (CHEMBL3936539) Show SMILES NC(=O)c1cc(ccc1O)-c1cn2cc(I)ccc2n1 Show InChI InChI=1S/C14H10IN3O2/c15-9-2-4-13-17-11(7-18(13)6-9)8-1-3-12(19)10(5-8)14(16)20/h1-7,19H,(H2,16,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris-Saclay Curated by ChEMBL					Assay Description Inhibition of DYRK1A (unknown origin)				Eur J Med Chem 123: 105-114 (2016) Article DOI: 10.1016/j.ejmech.2016.07.040 BindingDB Entry DOI: 10.7270/Q2GT5Q4M
					More data for this Ligand-Target Pair
Dual specificty protein kinase CLK1 (Homo sapiens (Human))	BDBM50204649 (CHEMBL3936539) Show SMILES NC(=O)c1cc(ccc1O)-c1cn2cc(I)ccc2n1 Show InChI InChI=1S/C14H10IN3O2/c15-9-2-4-13-17-11(7-18(13)6-9)8-1-3-12(19)10(5-8)14(16)20/h1-7,19H,(H2,16,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris-Saclay Curated by ChEMBL					Assay Description Inhibition of CLK1 (unknown origin)				Eur J Med Chem 123: 105-114 (2016) Article DOI: 10.1016/j.ejmech.2016.07.040 BindingDB Entry DOI: 10.7270/Q2GT5Q4M
					More data for this Ligand-Target Pair
Casein kinase I delta/epsilon (Homo sapiens (Human))	BDBM50204649 (CHEMBL3936539) Show SMILES NC(=O)c1cc(ccc1O)-c1cn2cc(I)ccc2n1 Show InChI InChI=1S/C14H10IN3O2/c15-9-2-4-13-17-11(7-18(13)6-9)8-1-3-12(19)10(5-8)14(16)20/h1-7,19H,(H2,16,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris-Saclay Curated by ChEMBL					Assay Description Inhibition of CK1 delta/epsilon (unknown origin)				Eur J Med Chem 123: 105-114 (2016) Article DOI: 10.1016/j.ejmech.2016.07.040 BindingDB Entry DOI: 10.7270/Q2GT5Q4M
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 (Homo sapiens (Human))	BDBM50204649 (CHEMBL3936539) Show SMILES NC(=O)c1cc(ccc1O)-c1cn2cc(I)ccc2n1 Show InChI InChI=1S/C14H10IN3O2/c15-9-2-4-13-17-11(7-18(13)6-9)8-1-3-12(19)10(5-8)14(16)20/h1-7,19H,(H2,16,20)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris-Saclay Curated by ChEMBL					Assay Description Inhibition of GSK-3 alpha/beta (unknown origin)				Eur J Med Chem 123: 105-114 (2016) Article DOI: 10.1016/j.ejmech.2016.07.040 BindingDB Entry DOI: 10.7270/Q2GT5Q4M
					More data for this Ligand-Target Pair