BDBM50510169 CHEMBL4584365

SMILES: CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC3CCNCC3)c2n1

InChI Key: InChIKey=BKDNXYLZMURERH-UHFFFAOYSA-N

Data: 3 IC50  1 EC50

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 = 50510169   

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 pim-1 (Homo sapiens (Human))	BDBM50510169 (CHEMBL4584365) Show SMILES CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC3CCNCC3)c2n1 Show InChI InChI=1S/C22H24N8O/c1-29-11-12-31-20-18(29)13-24-30-21(27-28-22(20)30)17-6-5-14-3-2-4-16(19(14)26-17)25-15-7-9-23-10-8-15/h2-6,13,15,23,25H,7-12H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.38E+3	n/a	n/a	n/a	n/a
Spanish National Cancer Research Centre (CNIO) Curated by ChEMBL					Assay Description Inhibition of PIM1 in human NCI-H1299 cells assessed as reduction in BAD phosphorylation at Ser-112 residue incubated for 4 hrs by ELISA				Eur J Med Chem 168: 87-109 (2019) Article DOI: 10.1016/j.ejmech.2019.02.022
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase pim-3 (Homo sapiens (Human))	BDBM50510169 (CHEMBL4584365) Show SMILES CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC3CCNCC3)c2n1 Show InChI InChI=1S/C22H24N8O/c1-29-11-12-31-20-18(29)13-24-30-21(27-28-22(20)30)17-6-5-14-3-2-4-16(19(14)26-17)25-15-7-9-23-10-8-15/h2-6,13,15,23,25H,7-12H2,1H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
Spanish National Cancer Research Centre (CNIO) Curated by ChEMBL					Assay Description Inhibition of N-terminal 6-His tagged human recombinant PIM3 using PIM tide (ARKRRRHPSGPPTA) as substrate incubated for 1 hr by fluorescence based as...				Eur J Med Chem 168: 87-109 (2019) Article DOI: 10.1016/j.ejmech.2019.02.022
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase pim-2 (Homo sapiens (Human))	BDBM50510169 (CHEMBL4584365) Show SMILES CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC3CCNCC3)c2n1 Show InChI InChI=1S/C22H24N8O/c1-29-11-12-31-20-18(29)13-24-30-21(27-28-22(20)30)17-6-5-14-3-2-4-16(19(14)26-17)25-15-7-9-23-10-8-15/h2-6,13,15,23,25H,7-12H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	690	n/a	n/a	n/a	n/a	n/a	n/a
Spanish National Cancer Research Centre (CNIO) Curated by ChEMBL					Assay Description Inhibition of His tagged human recombinant PIM2 using PIM tide (ARKRRRHPSGPPTA) as substrate incubated for 1 hr by fluorescence based assay				Eur J Med Chem 168: 87-109 (2019) Article DOI: 10.1016/j.ejmech.2019.02.022
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase pim-1 (Homo sapiens (Human))	BDBM50510169 (CHEMBL4584365) Show SMILES CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC3CCNCC3)c2n1 Show InChI InChI=1S/C22H24N8O/c1-29-11-12-31-20-18(29)13-24-30-21(27-28-22(20)30)17-6-5-14-3-2-4-16(19(14)26-17)25-15-7-9-23-10-8-15/h2-6,13,15,23,25H,7-12H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Spanish National Cancer Research Centre (CNIO) Curated by ChEMBL					Assay Description Inhibition of His tagged human recombinant PIM1 using PIM tide (ARKRRRHPSGPPTA) as substrate incubated for 1 hr by fluorescence based assay				Eur J Med Chem 168: 87-109 (2019) Article DOI: 10.1016/j.ejmech.2019.02.022
					More data for this Ligand-Target Pair