BDBM50059956 5-(3,4-DICHLOROPHENYL)-6-METHYLPYRIMIDINE-2,4-DIAMINE::5-(3,4-Dichloro-phenyl)-6-methyl-pyrimidine-2,4-diamine::5-(3,4-Dichloro-phenyl)-6-methyl-pyrimidine-2,4-diamine(Metoprine)::CHEMBL264373::DDMP5-(3,4-Dichloro-phenyl)-6-methyl-pyrimidine-2,4-diamine::METOPRINE::TCMDC-123931

SMILES: Cc1nc(N)nc(N)c1-c1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=VQJHOPSWBGJHQS-UHFFFAOYSA-N

Data: 1 KI

PDB links: 1 PDB ID matches this monomer.

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 1 hit for monomerid = 50059956   

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 (Rattus norvegicus (rat))	BDBM50059956 (5-(3,4-DICHLOROPHENYL)-6-METHYLPYRIMIDINE-2,4-DIAM...) Show SMILES Cc1nc(N)nc(N)c1-c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C11H10Cl2N4/c1-5-9(10(14)17-11(15)16-5)6-2-3-7(12)8(13)4-6/h2-4H,1H3,(H4,14,15,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	0.120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University Curated by ChEMBL					Assay Description Inhibitory activity of compound against rat liver Dihydrofolate reductase				J Med Chem 40: 3040-8 (1997) Article DOI: 10.1021/jm970055k BindingDB Entry DOI: 10.7270/Q2C53JZ2
					More data for this Ligand-Target Pair