BDBM50295877 4-[2-Amino-4-(1-methyl-1H-indol-3-yl)pyrimidin-5-yl]benzoic acid::CHEMBL563961

SMILES: Cn1cc(-c2nc(N)ncc2-c2ccc(cc2)C(O)=O)c2ccccc12

InChI Key: InChIKey=KQLPIHFVVIWKMP-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50295877   

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-(Y)-phosphorylation regulated kinase 1A (RAT)	BDBM50295877 (4-[2-Amino-4-(1-methyl-1H-indol-3-yl)pyrimidin-5-y...) Show SMILES Cn1cc(-c2nc(N)ncc2-c2ccc(cc2)C(O)=O)c2ccccc12 Show InChI InChI=1S/C20H16N4O2/c1-24-11-16(14-4-2-3-5-17(14)24)18-15(10-22-20(21)23-18)12-6-8-13(9-7-12)19(25)26/h2-11H,1H3,(H,25,26)(H2,21,22,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Clermont Universit£ Curated by ChEMBL					Assay Description Inhibition of rat recombinant DYRK1A expressed in Escherichia coli				Bioorg Med Chem 17: 4420-4 (2009) Article DOI: 10.1016/j.bmc.2009.05.017 BindingDB Entry DOI: 10.7270/Q2639PSH
					More data for this Ligand-Target Pair
ERK-2 (Rattus norvegicus (rat))	BDBM50295877 (4-[2-Amino-4-(1-methyl-1H-indol-3-yl)pyrimidin-5-y...) Show SMILES Cn1cc(-c2nc(N)ncc2-c2ccc(cc2)C(O)=O)c2ccccc12 Show InChI InChI=1S/C20H16N4O2/c1-24-11-16(14-4-2-3-5-17(14)24)18-15(10-22-20(21)23-18)12-6-8-13(9-7-12)19(25)26/h2-11H,1H3,(H,25,26)(H2,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Clermont Universit£ Curated by ChEMBL					Assay Description Inhibition of rat recombinant Erk2				Bioorg Med Chem 17: 4420-4 (2009) Article DOI: 10.1016/j.bmc.2009.05.017 BindingDB Entry DOI: 10.7270/Q2639PSH
					More data for this Ligand-Target Pair
Cyclin-dependent-like kinase 5 (Homo sapiens (Human))	BDBM50295877 (4-[2-Amino-4-(1-methyl-1H-indol-3-yl)pyrimidin-5-y...) Show SMILES Cn1cc(-c2nc(N)ncc2-c2ccc(cc2)C(O)=O)c2ccccc12 Show InChI InChI=1S/C20H16N4O2/c1-24-11-16(14-4-2-3-5-17(14)24)18-15(10-22-20(21)23-18)12-6-8-13(9-7-12)19(25)26/h2-11H,1H3,(H,25,26)(H2,21,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Clermont Universit£ Curated by ChEMBL					Assay Description Inhibition of human recombinant CDK5/p25				Bioorg Med Chem 17: 4420-4 (2009) Article DOI: 10.1016/j.bmc.2009.05.017 BindingDB Entry DOI: 10.7270/Q2639PSH
					More data for this Ligand-Target Pair