BDBM50536181 CHEMBL4576518

SMILES: Cl.NCc1ccc(cc1)-n1c(nc2ccc(nc12)-c1cn[nH]c1)-c1cccnc1N

InChI Key: InChIKey=ILVKGSGRGSOAHZ-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 = 50536181   

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
Serine/threonine-protein kinase AKT (Homo sapiens (Human))	BDBM50536181 (CHEMBL4576518) Show SMILES Cl.NCc1ccc(cc1)-n1c(nc2ccc(nc12)-c1cn[nH]c1)-c1cccnc1N Show InChI InChI=1S/C21H18N8/c22-10-13-3-5-15(6-4-13)29-20(16-2-1-9-24-19(16)23)28-18-8-7-17(27-21(18)29)14-11-25-26-12-14/h1-9,11-12H,10,22H2,(H2,23,24)(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
ArQule Inc. Curated by ChEMBL					Assay Description Inhibition of full length unphosphorylated AKT3 (1 to 479 residues) (unknown origin) expressed in baculovirus infected Sf9 insect cells using biotin-...				J Med Chem 59: 6455-69 (2016) Article DOI: 10.1021/acs.jmedchem.6b00619
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase AKT2 (Homo sapiens (Human))	BDBM50536181 (CHEMBL4576518) Show SMILES Cl.NCc1ccc(cc1)-n1c(nc2ccc(nc12)-c1cn[nH]c1)-c1cccnc1N Show InChI InChI=1S/C21H18N8/c22-10-13-3-5-15(6-4-13)29-20(16-2-1-9-24-19(16)23)28-18-8-7-17(27-21(18)29)14-11-25-26-12-14/h1-9,11-12H,10,22H2,(H2,23,24)(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
ArQule Inc. Curated by ChEMBL					Assay Description Inhibition of full length unphosphorylated AKT2 (1 to 481 residues) (unknown origin) expressed in baculovirus infected Sf9 insect cells using biotin-...				J Med Chem 59: 6455-69 (2016) Article DOI: 10.1021/acs.jmedchem.6b00619
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50536181 (CHEMBL4576518) Show SMILES Cl.NCc1ccc(cc1)-n1c(nc2ccc(nc12)-c1cn[nH]c1)-c1cccnc1N Show InChI InChI=1S/C21H18N8/c22-10-13-3-5-15(6-4-13)29-20(16-2-1-9-24-19(16)23)28-18-8-7-17(27-21(18)29)14-11-25-26-12-14/h1-9,11-12H,10,22H2,(H2,23,24)(H,25,26)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
ArQule Inc. Curated by ChEMBL					Assay Description Inhibition of full length unphosphorylated AKT1 (1 to 480 residues) (unknown origin) expressed in baculovirus infected Sf9 insect cells using biotin-...				J Med Chem 59: 6455-69 (2016) Article DOI: 10.1021/acs.jmedchem.6b00619
					More data for this Ligand-Target Pair