BDBM50090056 1-(3,4-Dichloro-phenyl)-6-phenyl-1,6-dihydro-[1,3,5]triazine-2,4-diamine::CHEMBL93974

SMILES: NC1=NC(N(C(N)=N1)c1ccc(Cl)c(Cl)c1)c1ccccc1

InChI Key: InChIKey=POHPGOJAYHKLEL-UHFFFAOYSA-N

Data: 2 KI

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 = 50090056   

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-Thymidylate Synthase (DHFR-TS) Mutant KICB1 (Plasmodium falciparum)	BDBM50090056 (1-(3,4-Dichloro-phenyl)-6-phenyl-1,6-dihydro-[1,3,...) Show SMILES NC1=NC(N(C(N)=N1)c1ccc(Cl)c(Cl)c1)c1ccccc1 |c:6,t:1| Show InChI InChI=1S/C15H13Cl2N5/c16-11-7-6-10(8-12(11)17)22-13(9-4-2-1-3-5-9)20-14(18)21-15(22)19/h1-8,13H,(H4,18,19,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Center for Genetic Engineering and Biotechnology Curated by ChEMBL					Assay Description Evaluated for inhibition constant (Ki wt) against Wild-type dihydrofolate reductase of Plasmodium falciparum				J Med Chem 43: 2738-44 (2000) BindingDB Entry DOI: 10.7270/Q2P55MRR
					More data for this Ligand-Target Pair
Dihydrofolate reductase (A16V+S108T) (Plasmodium falciparum)	BDBM50090056 (1-(3,4-Dichloro-phenyl)-6-phenyl-1,6-dihydro-[1,3,...) Show SMILES NC1=NC(N(C(N)=N1)c1ccc(Cl)c(Cl)c1)c1ccccc1 |c:6,t:1| Show InChI InChI=1S/C15H13Cl2N5/c16-11-7-6-10(8-12(11)17)22-13(9-4-2-1-3-5-9)20-14(18)21-15(22)19/h1-8,13H,(H4,18,19,20,21)	PDB MMDB KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Center for Genetic Engineering and Biotechnology Curated by ChEMBL					Assay Description Evaluated for inhibition constant (Ki mut) against A16V+S108T Mutant dihydrofolate reductase of Plasmodium falciparum				J Med Chem 43: 2738-44 (2000) BindingDB Entry DOI: 10.7270/Q2P55MRR
					More data for this Ligand-Target Pair