BDBM50107990 CHEMBL359144::xv5-Methyl-6-(pyren-1-ylaminomethyl)-pyrido[2,3-d]pyrimidineamine

SMILES: Cc1c(CNc2ccc3ccc4cccc5ccc2c3c45)cnc2nc(N)nc(N)c12

InChI Key: InChIKey=ZXPLJUACCJOOLA-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50107990   

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
Dihydrofolate reductase (Homo sapiens (Human))	BDBM50107990 (CHEMBL359144 | xv5-Methyl-6-(pyren-1-ylaminomethyl...) Show SMILES Cc1c(CNc2ccc3ccc4cccc5ccc2c3c45)cnc2nc(N)nc(N)c12 Show InChI InChI=1S/C25H20N6/c1-13-17(12-29-24-20(13)23(26)30-25(27)31-24)11-28-19-10-8-16-6-5-14-3-2-4-15-7-9-18(19)22(16)21(14)15/h2-10,12,28H,11H2,1H3,(H4,26,27,29,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.880	n/a	n/a	n/a	n/a	n/a	n/a
Lindsley F. Kimball Research Institute Curated by ChEMBL					Assay Description Antimycobacterial activity against Mycobacterium avium complex diihydrofolate reductase (MAC DHFR)				J Med Chem 45: 41-53 (2001) BindingDB Entry DOI: 10.7270/Q2FQ9VXR
					More data for this Ligand-Target Pair
Dihydrofolate reductase (Homo sapiens (Human))	BDBM50107990 (CHEMBL359144 | xv5-Methyl-6-(pyren-1-ylaminomethyl...) Show SMILES Cc1c(CNc2ccc3ccc4cccc5ccc2c3c45)cnc2nc(N)nc(N)c12 Show InChI InChI=1S/C25H20N6/c1-13-17(12-29-24-20(13)23(26)30-25(27)31-24)11-28-19-10-8-16-6-5-14-3-2-4-15-7-9-18(19)22(16)21(14)15/h2-10,12,28H,11H2,1H3,(H4,26,27,29,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
Lindsley F. Kimball Research Institute Curated by ChEMBL					Assay Description Antimycobacterial activity against human dihydrofolate reductase (hDHFR)				J Med Chem 45: 41-53 (2001) BindingDB Entry DOI: 10.7270/Q2FQ9VXR
					More data for this Ligand-Target Pair