BDBM50431027 CHEMBL2036343

SMILES: O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1

InChI Key: InChIKey=SZUIRPWFHMMLIA-UTLPMFLDSA-N

Data: 12 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 12 hits for monomerid = 50431027   

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
MAP kinase-activated protein kinase 2 (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant MAPKAPK2 (unknown origin) by FRET-based Z'-LYTE assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant MAPK14 (unknown origin) by FRET-based Z'-LYTE assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant KDR (unknown origin) by FRET-based Z'-LYTE assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase Nek1 (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant NEK1 (unknown origin) by FRET-based Z'-LYTE assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 1 (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant ERK2 (unknown origin) by FRET-based Z'-LYTE assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant AKT1 (unknown origin) by FRET-based Z'-LYTE assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant RAF1 (unknown origin) by cascade reaction assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
5'-AMP-activated protein kinase Complex 1 (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant AMPK A1/B1/G1 (unknown origin) by FRET-based Z'-LYTE assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
Ribosomal protein S6 kinase (P70S6K) (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant RPS6K1 (unknown origin) by FRET-based Z'-LYTE assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant IKBKB (unknown origin) by FRET-based Z'-LYTE assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase AKT2 (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant AKT2 (unknown origin) by FRET-based Z'-LYTE assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1 (Homo sapiens (Human))	BDBM50431027 (CHEMBL2036343) Show SMILES O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1 Show InChI InChI=1S/C17H14N2OS/c20-17-13(9-15-5-1-3-7-18-15)11-21-12-14(17)10-16-6-2-4-8-19-16/h1-10H,11-12H2/b13-9+,14-10+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Curated by ChEMBL					Assay Description Inhibition of recombinant MEK1 (unknown origin) by cascade reaction assay				J Med Chem 56: 3456-66 (2013) Article DOI: 10.1021/jm4002692 BindingDB Entry DOI: 10.7270/Q2SB473Z
					More data for this Ligand-Target Pair