null

SMILES: CN(CC1CCc2nc(N)nc(N)c2C1)c1cccc2ccccc12

InChI Key: InChIKey=GUIFHQSZBXGPLV-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50033544   

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
Bifunctional dihydrofolate reductase-thymidylate synthase (Toxoplasma gondii)	BDBM50033544 (6-[(Methyl-naphthalen-1-yl-amino)-methyl]-5,6,7,8-...) Show SMILES CN(CC1CCc2nc(N)nc(N)c2C1)c1cccc2ccccc12 Show InChI InChI=1S/C20H23N5/c1-25(18-8-4-6-14-5-2-3-7-15(14)18)12-13-9-10-17-16(11-13)19(21)24-20(22)23-17/h2-8,13H,9-12H2,1H3,(H4,21,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibitory activity against purified Dihydrofolate reductase from Toxoplasma gondii.				J Med Chem 38: 3660-8 (1995) BindingDB Entry DOI: 10.7270/Q27080FN
					More data for this Ligand-Target Pair
Dihydrofolate reductase (Pneumocystis carinii)	BDBM50033544 (6-[(Methyl-naphthalen-1-yl-amino)-methyl]-5,6,7,8-...) Show SMILES CN(CC1CCc2nc(N)nc(N)c2C1)c1cccc2ccccc12 Show InChI InChI=1S/C20H23N5/c1-25(18-8-4-6-14-5-2-3-7-15(14)18)12-13-9-10-17-16(11-13)19(21)24-20(22)23-17/h2-8,13H,9-12H2,1H3,(H4,21,22,23,24)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibitory activity against purified dihydrofolate reductase from Pneumocystis carinii.				J Med Chem 38: 3660-8 (1995) BindingDB Entry DOI: 10.7270/Q27080FN
					More data for this Ligand-Target Pair
Dihydrofolate reductase (Rattus norvegicus (rat))	BDBM50033544 (6-[(Methyl-naphthalen-1-yl-amino)-methyl]-5,6,7,8-...) Show SMILES CN(CC1CCc2nc(N)nc(N)c2C1)c1cccc2ccccc12 Show InChI InChI=1S/C20H23N5/c1-25(18-8-4-6-14-5-2-3-7-15(14)18)12-13-9-10-17-16(11-13)19(21)24-20(22)23-17/h2-8,13H,9-12H2,1H3,(H4,21,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of rat liver dihydrofolate reductase				J Med Chem 48: 1448-69 (2005) Article DOI: 10.1021/jm040153n BindingDB Entry DOI: 10.7270/Q2V40TQ3
					More data for this Ligand-Target Pair
Bifunctional dihydrofolate reductase-thymidylate synthase (Toxoplasma gondii)	BDBM50033544 (6-[(Methyl-naphthalen-1-yl-amino)-methyl]-5,6,7,8-...) Show SMILES CN(CC1CCc2nc(N)nc(N)c2C1)c1cccc2ccccc12 Show InChI InChI=1S/C20H23N5/c1-25(18-8-4-6-14-5-2-3-7-15(14)18)12-13-9-10-17-16(11-13)19(21)24-20(22)23-17/h2-8,13H,9-12H2,1H3,(H4,21,22,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of Toxoplasma gondii dihydrofolate reductase				J Med Chem 48: 1448-69 (2005) Article DOI: 10.1021/jm040153n BindingDB Entry DOI: 10.7270/Q2V40TQ3
					More data for this Ligand-Target Pair
Dihydrofolate reductase (Pneumocystis carinii)	BDBM50033544 (6-[(Methyl-naphthalen-1-yl-amino)-methyl]-5,6,7,8-...) Show SMILES CN(CC1CCc2nc(N)nc(N)c2C1)c1cccc2ccccc12 Show InChI InChI=1S/C20H23N5/c1-25(18-8-4-6-14-5-2-3-7-15(14)18)12-13-9-10-17-16(11-13)19(21)24-20(22)23-17/h2-8,13H,9-12H2,1H3,(H4,21,22,23,24)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of Pneumocystis carinii dihydrofolate reductase				J Med Chem 48: 1448-69 (2005) Article DOI: 10.1021/jm040153n BindingDB Entry DOI: 10.7270/Q2V40TQ3
					More data for this Ligand-Target Pair
Dihydrofolate reductase (Rattus norvegicus (rat))	BDBM50033544 (6-[(Methyl-naphthalen-1-yl-amino)-methyl]-5,6,7,8-...) Show SMILES CN(CC1CCc2nc(N)nc(N)c2C1)c1cccc2ccccc12 Show InChI InChI=1S/C20H23N5/c1-25(18-8-4-6-14-5-2-3-7-15(14)18)12-13-9-10-17-16(11-13)19(21)24-20(22)23-17/h2-8,13H,9-12H2,1H3,(H4,21,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibitory activity against purified dihydrofolate reductase from rat				J Med Chem 38: 3660-8 (1995) BindingDB Entry DOI: 10.7270/Q27080FN
					More data for this Ligand-Target Pair