Compile Data Set for Download or QSAR

Found 5 hits of ki for monomerid = 50138953   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Bifunctional dihydrofolate reductase-thymidylate synthase (Plasmodium falciparum (isolate K1 / Thailand))	BDBM50138953 (1-(4-Chloro-phenyl)-6-hexyl-6-methyl-1,6-dihydro-[...) Show SMILES CCCCCCC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1 |t:8,11| Show InChI InChI=1S/C16H24ClN5/c1-3-4-5-6-11-16(2)21-14(18)20-15(19)22(16)13-9-7-12(17)8-10-13/h7-10H,3-6,11H2,1-2H3,(H4,18,19,20,21)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.600	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 Binding affinity towards wild-type dihydrofolate reductase of Plasmodium falciparum.				J Med Chem 47: 673-80 (2004) Article DOI: 10.1021/jm030165t BindingDB Entry DOI: 10.7270/Q2ST7P8J
					More data for this Ligand-Target Pair
Bifunctional dihydrofolate reductase-thymidylate synthase (Plasmodium falciparum (isolate K1 / Thailand))	BDBM50138953 (1-(4-Chloro-phenyl)-6-hexyl-6-methyl-1,6-dihydro-[...) Show SMILES CCCCCCC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1 |t:8,11| Show InChI InChI=1S/C16H24ClN5/c1-3-4-5-6-11-16(2)21-14(18)20-15(19)22(16)13-9-7-12(17)8-10-13/h7-10H,3-6,11H2,1-2H3,(H4,18,19,20,21)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11.3	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 Binding affinity towards mutant dihydrofolate reductase (N51I+C59R+S108N DHFR) of Plasmodium falciparum				J Med Chem 47: 673-80 (2004) Article DOI: 10.1021/jm030165t BindingDB Entry DOI: 10.7270/Q2ST7P8J
					More data for this Ligand-Target Pair
Bifunctional dihydrofolate reductase-thymidylate synthase (Plasmodium falciparum (isolate K1 / Thailand))	BDBM50138953 (1-(4-Chloro-phenyl)-6-hexyl-6-methyl-1,6-dihydro-[...) Show SMILES CCCCCCC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1 |t:8,11| Show InChI InChI=1S/C16H24ClN5/c1-3-4-5-6-11-16(2)21-14(18)20-15(19)22(16)13-9-7-12(17)8-10-13/h7-10H,3-6,11H2,1-2H3,(H4,18,19,20,21)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	41.8	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 Binding affinity towards mutant dihydrofolate reductase (C59R+S108N+I164L DHFR) of Plasmodium falciparum				J Med Chem 47: 673-80 (2004) Article DOI: 10.1021/jm030165t BindingDB Entry DOI: 10.7270/Q2ST7P8J
					More data for this Ligand-Target Pair
Bifunctional dihydrofolate reductase-thymidylate synthase (Plasmodium falciparum (isolate K1 / Thailand))	BDBM50138953 (1-(4-Chloro-phenyl)-6-hexyl-6-methyl-1,6-dihydro-[...) Show SMILES CCCCCCC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1 |t:8,11| Show InChI InChI=1S/C16H24ClN5/c1-3-4-5-6-11-16(2)21-14(18)20-15(19)22(16)13-9-7-12(17)8-10-13/h7-10H,3-6,11H2,1-2H3,(H4,18,19,20,21)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	69.2	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 Binding affinity towards mutant dihydrofolate reductase (N51I+C59R+S108N+I164L DHFR) of Plasmodium falciparum				J Med Chem 47: 673-80 (2004) Article DOI: 10.1021/jm030165t BindingDB Entry DOI: 10.7270/Q2ST7P8J
					More data for this Ligand-Target Pair
Bifunctional dihydrofolate reductase-thymidylate synthase (Plasmodium falciparum (isolate K1 / Thailand))	BDBM50138953 (1-(4-Chloro-phenyl)-6-hexyl-6-methyl-1,6-dihydro-[...) Show SMILES CCCCCCC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1 |t:8,11| Show InChI InChI=1S/C16H24ClN5/c1-3-4-5-6-11-16(2)21-14(18)20-15(19)22(16)13-9-7-12(17)8-10-13/h7-10H,3-6,11H2,1-2H3,(H4,18,19,20,21)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	955	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 Binding affinity towards mutant dihydrofolate reductase (A16V+S108T DHFR) of Plasmodium falciparum.				J Med Chem 47: 673-80 (2004) Article DOI: 10.1021/jm030165t BindingDB Entry DOI: 10.7270/Q2ST7P8J
					More data for this Ligand-Target Pair