Found 56 hits of Enzyme Inhibition Constant Data 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 |
|---|
Dihydrofolate reductase
(Mycobacterium avium) | BDBM50253581
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-ethylamin...)Show InChI InChI=1S/C19H23N5O2/c1-4-24(11-12-9-14(25-2)6-8-17(12)26-3)13-5-7-16-15(10-13)18(20)23-19(21)22-16/h5-10H,4,11H2,1-3H3,(H4,20,21,22,23) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.980 | n/a | n/a | n/a | n/a | n/a | n/a |
Duquesne University
Curated by ChEMBL
| Assay Description
Inhibition of Mycobacterium avium dihydrofolate reductase |
J Med Chem 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Mycobacterium avium) | BDBM50253578
(2,4-Diamino-6-[N-(benzyl)-N-ethylamino]quinazoline...)Show InChI InChI=1S/C17H19N5/c1-2-22(11-12-6-4-3-5-7-12)13-8-9-15-14(10-13)16(18)21-17(19)20-15/h3-10H,2,11H2,1H3,(H4,18,19,20,21) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Duquesne University
Curated by ChEMBL
| Assay Description
Inhibition of Mycobacterium avium dihydrofolate reductase |
J Med Chem 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Mycobacterium avium) | BDBM50253580
(2,4-Diamino-6-[N-(beta-naphthyl)-N-ethylamino]quin...)Show InChI InChI=1S/C21H21N5/c1-2-26(13-14-7-8-15-5-3-4-6-16(15)11-14)17-9-10-19-18(12-17)20(22)25-21(23)24-19/h3-12H,2,13H2,1H3,(H4,22,23,24,25) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Duquesne University
Curated by ChEMBL
| Assay Description
Inhibition of Mycobacterium avium dihydrofolate reductase |
J Med Chem 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50253579
(2,4-Diamino-6-[N-(alpha-naphthyl)-N-ethylamino]qui...)Show InChI InChI=1S/C21H21N5/c1-2-26(13-15-8-5-7-14-6-3-4-9-17(14)15)16-10-11-19-18(12-16)20(22)25-21(23)24-19/h3-12H,2,13H2,1H3,(H4,22,23,24,25) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.5 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Mycobacterium avium) | BDBM50253579
(2,4-Diamino-6-[N-(alpha-naphthyl)-N-ethylamino]qui...)Show InChI InChI=1S/C21H21N5/c1-2-26(13-15-8-5-7-14-6-3-4-9-17(14)15)16-10-11-19-18(12-16)20(22)25-21(23)24-19/h3-12H,2,13H2,1H3,(H4,22,23,24,25) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Duquesne University
Curated by ChEMBL
| Assay Description
Inhibition of Mycobacterium avium dihydrofolate reductase |
J Med Chem 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM18268
(5-methyl-6-{[(3,4,5-trimethoxyphenyl)amino]methyl}...)Show InChI InChI=1S/C19H23N5O3/c1-10-11(5-6-13-16(10)18(20)24-19(21)23-13)9-22-12-7-14(25-2)17(27-4)15(8-12)26-3/h5-8,22H,9H2,1-4H3,(H4,20,21,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Mycobacterium avium) | BDBM50253612
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-propylami...)Show InChI InChI=1S/C20H25N5O2/c1-4-9-25(12-13-10-15(26-2)6-8-18(13)27-3)14-5-7-17-16(11-14)19(21)24-20(22)23-17/h5-8,10-11H,4,9,12H2,1-3H3,(H4,21,22,23,24) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Duquesne University
Curated by ChEMBL
| Assay Description
Inhibition of Mycobacterium avium dihydrofolate reductase |
J Med Chem 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50253578
(2,4-Diamino-6-[N-(benzyl)-N-ethylamino]quinazoline...)Show InChI InChI=1S/C17H19N5/c1-2-22(11-12-6-4-3-5-7-12)13-8-9-15-14(10-13)16(18)21-17(19)20-15/h3-10H,2,11H2,1H3,(H4,18,19,20,21) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.60 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50253581
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-ethylamin...)Show InChI InChI=1S/C19H23N5O2/c1-4-24(11-12-9-14(25-2)6-8-17(12)26-3)13-5-7-16-15(10-13)18(20)23-19(21)22-16/h5-10H,4,11H2,1-3H3,(H4,20,21,22,23) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.70 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50253578
(2,4-Diamino-6-[N-(benzyl)-N-ethylamino]quinazoline...)Show InChI InChI=1S/C17H19N5/c1-2-22(11-12-6-4-3-5-7-12)13-8-9-15-14(10-13)16(18)21-17(19)20-15/h3-10H,2,11H2,1H3,(H4,18,19,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.10 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM18224
(6-[(2,5-dimethoxyphenyl)methyl]-5-methylpyrido[2,3...)Show InChI InChI=1S/C17H19N5O2/c1-9-11(6-10-7-12(23-2)4-5-13(10)24-3)8-20-16-14(9)15(18)21-17(19)22-16/h4-5,7-8H,6H2,1-3H3,(H4,18,19,20,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| MMDB
PDB
Article
PubMed
| n/a | n/a | 4.40 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50253581
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-ethylamin...)Show InChI InChI=1S/C19H23N5O2/c1-4-24(11-12-9-14(25-2)6-8-17(12)26-3)13-5-7-16-15(10-13)18(20)23-19(21)22-16/h5-10H,4,11H2,1-3H3,(H4,20,21,22,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.80 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50253612
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-propylami...)Show InChI InChI=1S/C20H25N5O2/c1-4-9-25(12-13-10-15(26-2)6-8-18(13)27-3)14-5-7-17-16(11-14)19(21)24-20(22)23-17/h5-8,10-11H,4,9,12H2,1-3H3,(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 | 5.30 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50051913
(CHEMBL32113 | N*6*-(2,5-Dimethoxy-benzyl)-N*6*-met...)Show InChI InChI=1S/C17H20N6O2/c1-23(9-10-6-12(24-2)4-5-14(10)25-3)11-7-13-15(18)21-17(19)22-16(13)20-8-11/h4-8H,9H2,1-3H3,(H4,18,19,20,21,22) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 6.30 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50253579
(2,4-Diamino-6-[N-(alpha-naphthyl)-N-ethylamino]qui...)Show InChI InChI=1S/C21H21N5/c1-2-26(13-15-8-5-7-14-6-3-4-9-17(14)15)16-10-11-19-18(12-16)20(22)25-21(23)24-19/h3-12H,2,13H2,1H3,(H4,22,23,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.5 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50253611
(2,4-Diamino-6-[N-(2,3,5-trichlorobenzyl)-N-ethylam...)Show SMILES CCN(Cc1cc(Cl)cc(Cl)c1Cl)c1ccc2nc(N)nc(N)c2c1 Show InChI InChI=1S/C17H16Cl3N5/c1-2-25(8-9-5-10(18)6-13(19)15(9)20)11-3-4-14-12(7-11)16(21)24-17(22)23-14/h3-7H,2,8H2,1H3,(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 | 6.90 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50253580
(2,4-Diamino-6-[N-(beta-naphthyl)-N-ethylamino]quin...)Show InChI InChI=1S/C21H21N5/c1-2-26(13-14-7-8-15-5-3-4-6-16(15)11-14)17-9-10-19-18(12-17)20(22)25-21(23)24-19/h3-12H,2,13H2,1H3,(H4,22,23,24,25) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.20 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50253614
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-cycloprop...)Show InChI InChI=1S/C21H27N5O2/c1-4-5-10-26(13-14-11-16(27-2)7-9-19(14)28-3)15-6-8-18-17(12-15)20(22)25-21(23)24-18/h6-9,11-12H,4-5,10,13H2,1-3H3,(H4,22,23,24,25) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.30 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50253579
(2,4-Diamino-6-[N-(alpha-naphthyl)-N-ethylamino]qui...)Show InChI InChI=1S/C21H21N5/c1-2-26(13-15-8-5-7-14-6-3-4-9-17(14)15)16-10-11-19-18(12-16)20(22)25-21(23)24-19/h3-12H,2,13H2,1H3,(H4,22,23,24,25) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.80 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50253612
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-propylami...)Show InChI InChI=1S/C20H25N5O2/c1-4-9-25(12-13-10-15(26-2)6-8-18(13)27-3)14-5-7-17-16(11-14)19(21)24-20(22)23-17/h5-8,10-11H,4,9,12H2,1-3H3,(H4,21,22,23,24) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.5 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50253614
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-cycloprop...)Show InChI InChI=1S/C21H27N5O2/c1-4-5-10-26(13-14-11-16(27-2)7-9-19(14)28-3)15-6-8-18-17(12-15)20(22)25-21(23)24-18/h6-9,11-12H,4-5,10,13H2,1-3H3,(H4,22,23,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.60 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50253581
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-ethylamin...)Show InChI InChI=1S/C19H23N5O2/c1-4-24(11-12-9-14(25-2)6-8-17(12)26-3)13-5-7-16-15(10-13)18(20)23-19(21)22-16/h5-10H,4,11H2,1-3H3,(H4,20,21,22,23) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.90 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM18268
(5-methyl-6-{[(3,4,5-trimethoxyphenyl)amino]methyl}...)Show InChI InChI=1S/C19H23N5O3/c1-10-11(5-6-13-16(10)18(20)24-19(21)23-13)9-22-12-7-14(25-2)17(27-4)15(8-12)26-3/h5-8,22H,9H2,1-4H3,(H4,20,21,23,24) | PDB
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PC cid
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| Article
PubMed
| n/a | n/a | 10 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50253580
(2,4-Diamino-6-[N-(beta-naphthyl)-N-ethylamino]quin...)Show InChI InChI=1S/C21H21N5/c1-2-26(13-14-7-8-15-5-3-4-6-16(15)11-14)17-9-10-19-18(12-17)20(22)25-21(23)24-19/h3-12H,2,13H2,1H3,(H4,22,23,24,25) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Mycobacterium avium) | BDBM50253613
(2,4-Diamino-6-[N-(beta-naphthyl)-N-propylamino]qui...)Show InChI InChI=1S/C22H23N5/c1-2-11-27(14-15-7-8-16-5-3-4-6-17(16)12-15)18-9-10-20-19(13-18)21(23)26-22(24)25-20/h3-10,12-13H,2,11,14H2,1H3,(H4,23,24,25,26) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Duquesne University
Curated by ChEMBL
| Assay Description
Inhibition of Mycobacterium avium dihydrofolate reductase |
J Med Chem 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Mycobacterium avium) | BDBM50253611
(2,4-Diamino-6-[N-(2,3,5-trichlorobenzyl)-N-ethylam...)Show SMILES CCN(Cc1cc(Cl)cc(Cl)c1Cl)c1ccc2nc(N)nc(N)c2c1 Show InChI InChI=1S/C17H16Cl3N5/c1-2-25(8-9-5-10(18)6-13(19)15(9)20)11-3-4-14-12(7-11)16(21)24-17(22)23-14/h3-7H,2,8H2,1H3,(H4,21,22,23,24) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Duquesne University
Curated by ChEMBL
| Assay Description
Inhibition of Mycobacterium avium dihydrofolate reductase |
J Med Chem 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50253580
(2,4-Diamino-6-[N-(beta-naphthyl)-N-ethylamino]quin...)Show InChI InChI=1S/C21H21N5/c1-2-26(13-14-7-8-15-5-3-4-6-16(15)11-14)17-9-10-19-18(12-17)20(22)25-21(23)24-19/h3-12H,2,13H2,1H3,(H4,22,23,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 14.5 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Mycobacterium avium) | BDBM50253614
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-cycloprop...)Show InChI InChI=1S/C21H27N5O2/c1-4-5-10-26(13-14-11-16(27-2)7-9-19(14)28-3)15-6-8-18-17(12-15)20(22)25-21(23)24-18/h6-9,11-12H,4-5,10,13H2,1-3H3,(H4,22,23,24,25) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Duquesne University
Curated by ChEMBL
| Assay Description
Inhibition of Mycobacterium avium dihydrofolate reductase |
J Med Chem 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50253615
(2,4-Diamino-6-[N-(beta-naphthyl)-N-cyclopropyl met...)Show InChI InChI=1S/C23H25N5/c1-2-3-12-28(15-16-8-9-17-6-4-5-7-18(17)13-16)19-10-11-21-20(14-19)22(24)27-23(25)26-21/h4-11,13-14H,2-3,12,15H2,1H3,(H4,24,25,26,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 16 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50253613
(2,4-Diamino-6-[N-(beta-naphthyl)-N-propylamino]qui...)Show InChI InChI=1S/C22H23N5/c1-2-11-27(14-15-7-8-16-5-3-4-6-17(16)12-15)18-9-10-20-19(13-18)21(23)26-22(24)25-20/h3-10,12-13H,2,11,14H2,1H3,(H4,23,24,25,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 17 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50253611
(2,4-Diamino-6-[N-(2,3,5-trichlorobenzyl)-N-ethylam...)Show SMILES CCN(Cc1cc(Cl)cc(Cl)c1Cl)c1ccc2nc(N)nc(N)c2c1 Show InChI InChI=1S/C17H16Cl3N5/c1-2-25(8-9-5-10(18)6-13(19)15(9)20)11-3-4-14-12(7-11)16(21)24-17(22)23-14/h3-7H,2,8H2,1H3,(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 | 19 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50253613
(2,4-Diamino-6-[N-(beta-naphthyl)-N-propylamino]qui...)Show InChI InChI=1S/C22H23N5/c1-2-11-27(14-15-7-8-16-5-3-4-6-17(16)12-15)18-9-10-20-19(13-18)21(23)26-22(24)25-20/h3-10,12-13H,2,11,14H2,1H3,(H4,23,24,25,26) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 19 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50253611
(2,4-Diamino-6-[N-(2,3,5-trichlorobenzyl)-N-ethylam...)Show SMILES CCN(Cc1cc(Cl)cc(Cl)c1Cl)c1ccc2nc(N)nc(N)c2c1 Show InChI InChI=1S/C17H16Cl3N5/c1-2-25(8-9-5-10(18)6-13(19)15(9)20)11-3-4-14-12(7-11)16(21)24-17(22)23-14/h3-7H,2,8H2,1H3,(H4,21,22,23,24) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 19 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50253578
(2,4-Diamino-6-[N-(benzyl)-N-ethylamino]quinazoline...)Show InChI InChI=1S/C17H19N5/c1-2-22(11-12-6-4-3-5-7-12)13-8-9-15-14(10-13)16(18)21-17(19)20-15/h3-10H,2,11H2,1H3,(H4,18,19,20,21) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 21 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50253615
(2,4-Diamino-6-[N-(beta-naphthyl)-N-cyclopropyl met...)Show InChI InChI=1S/C23H25N5/c1-2-3-12-28(15-16-8-9-17-6-4-5-7-18(17)13-16)19-10-11-21-20(14-19)22(24)27-23(25)26-21/h4-11,13-14H,2-3,12,15H2,1H3,(H4,24,25,26,27) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 25 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50253614
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-cycloprop...)Show InChI InChI=1S/C21H27N5O2/c1-4-5-10-26(13-14-11-16(27-2)7-9-19(14)28-3)15-6-8-18-17(12-15)20(22)25-21(23)24-18/h6-9,11-12H,4-5,10,13H2,1-3H3,(H4,22,23,24,25) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 25 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50066490
(2,4-DIAMINO-6-[N-(2',5'-DIMETHOXYBENZYL)-N-METHYLA...)Show InChI InChI=1S/C18H21N5O2/c1-23(10-11-8-13(24-2)5-7-16(11)25-3)12-4-6-15-14(9-12)17(19)22-18(20)21-15/h4-9H,10H2,1-3H3,(H4,19,20,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | 26 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50253613
(2,4-Diamino-6-[N-(beta-naphthyl)-N-propylamino]qui...)Show InChI InChI=1S/C22H23N5/c1-2-11-27(14-15-7-8-16-5-3-4-6-17(16)12-15)18-9-10-20-19(13-18)21(23)26-22(24)25-20/h3-10,12-13H,2,11,14H2,1H3,(H4,23,24,25,26) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 27 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50066490
(2,4-DIAMINO-6-[N-(2',5'-DIMETHOXYBENZYL)-N-METHYLA...)Show InChI InChI=1S/C18H21N5O2/c1-23(10-11-8-13(24-2)5-7-16(11)25-3)12-4-6-15-14(9-12)17(19)22-18(20)21-15/h4-9H,10H2,1-3H3,(H4,19,20,21,22) | PDB
UniProtKB/SwissProt
GoogleScholar
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| CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | 30 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Mycobacterium avium) | BDBM50253615
(2,4-Diamino-6-[N-(beta-naphthyl)-N-cyclopropyl met...)Show InChI InChI=1S/C23H25N5/c1-2-3-12-28(15-16-8-9-17-6-4-5-7-18(17)13-16)19-10-11-21-20(14-19)22(24)27-23(25)26-21/h4-11,13-14H,2-3,12,15H2,1H3,(H4,24,25,26,27) | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
Duquesne University
Curated by ChEMBL
| Assay Description
Inhibition of Mycobacterium avium dihydrofolate reductase |
J Med Chem 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM18224
(6-[(2,5-dimethoxyphenyl)methyl]-5-methylpyrido[2,3...)Show InChI InChI=1S/C17H19N5O2/c1-9-11(6-10-7-12(23-2)4-5-13(10)24-3)8-20-16-14(9)15(18)21-17(19)22-16/h4-5,7-8H,6H2,1-3H3,(H4,18,19,20,21,22) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
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CHEMBL
DrugBank
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PC cid
PC sid
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UniChem
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| Article
PubMed
| n/a | n/a | 34.3 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50253612
(2,4-Diamino-6-[N-(2,5-dimethoxybenzyl)-N-propylami...)Show InChI InChI=1S/C20H25N5O2/c1-4-9-25(12-13-10-15(26-2)6-8-18(13)27-3)14-5-7-17-16(11-14)19(21)24-20(22)23-17/h5-8,10-11H,4,9,12H2,1-3H3,(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 | 38 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM18268
(5-methyl-6-{[(3,4,5-trimethoxyphenyl)amino]methyl}...)Show InChI InChI=1S/C19H23N5O3/c1-10-11(5-6-13-16(10)18(20)24-19(21)23-13)9-22-12-7-14(25-2)17(27-4)15(8-12)26-3/h5-8,22H,9H2,1-4H3,(H4,20,21,23,24) | PDB
MMDB
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CHEMBL
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MCE
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PC cid
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UniChem
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| Article
PubMed
| n/a | n/a | 42 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50253615
(2,4-Diamino-6-[N-(beta-naphthyl)-N-cyclopropyl met...)Show InChI InChI=1S/C23H25N5/c1-2-3-12-28(15-16-8-9-17-6-4-5-7-18(17)13-16)19-10-11-21-20(14-19)22(24)27-23(25)26-21/h4-11,13-14H,2-3,12,15H2,1H3,(H4,24,25,26,27) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 42 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50051913
(CHEMBL32113 | N*6*-(2,5-Dimethoxy-benzyl)-N*6*-met...)Show InChI InChI=1S/C17H20N6O2/c1-23(9-10-6-12(24-2)4-5-14(10)25-3)11-7-13-15(18)21-17(19)22-16(13)20-8-11/h4-8H,9H2,1-3H3,(H4,18,19,20,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| MMDB
Article
PubMed
| n/a | n/a | 57 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50051913
(CHEMBL32113 | N*6*-(2,5-Dimethoxy-benzyl)-N*6*-met...)Show InChI InChI=1S/C17H20N6O2/c1-23(9-10-6-12(24-2)4-5-14(10)25-3)11-7-13-15(18)21-17(19)22-16(13)20-8-11/h4-8H,9H2,1-3H3,(H4,18,19,20,21,22) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 84 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50066490
(2,4-DIAMINO-6-[N-(2',5'-DIMETHOXYBENZYL)-N-METHYLA...)Show InChI InChI=1S/C18H21N5O2/c1-23(10-11-8-13(24-2)5-7-16(11)25-3)12-4-6-15-14(9-12)17(19)22-18(20)21-15/h4-9H,10H2,1-3H3,(H4,19,20,21,22) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| DrugBank
MMDB
PDB
Article
PubMed
| n/a | n/a | 87 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50066494
(CHEMBL116816 | N*6*-(2,5-Dimethoxy-benzyl)-quinazo...)Show InChI InChI=1S/C17H19N5O2/c1-23-12-4-6-15(24-2)10(7-12)9-20-11-3-5-14-13(8-11)16(18)22-17(19)21-14/h3-8,20H,9H2,1-2H3,(H4,18,19,21,22) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 160 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM50051915
(CHEMBL32708 | N*6*-(2,5-Dimethoxy-benzyl)-pyrido[2...)Show InChI InChI=1S/C16H18N6O2/c1-23-11-3-4-13(24-2)9(5-11)7-19-10-6-12-14(17)21-16(18)22-15(12)20-8-10/h3-6,8,19H,7H2,1-2H3,(H4,17,18,20,21,22) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 310 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50051915
(CHEMBL32708 | N*6*-(2,5-Dimethoxy-benzyl)-pyrido[2...)Show InChI InChI=1S/C16H18N6O2/c1-23-11-3-4-13(24-2)9(5-11)7-19-10-6-12-14(17)21-16(18)22-15(12)20-8-10/h3-6,8,19H,7H2,1-2H3,(H4,17,18,20,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 350 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Bifunctional dihydrofolate reductase-thymidylate synthase
(Toxoplasma gondii) | BDBM18069
(5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-d...)Show InChI InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18) | PDB
UniProtKB/SwissProt
GoogleScholar
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| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
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| Article
PubMed
| n/a | n/a | 2.70E+3 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50051915
(CHEMBL32708 | N*6*-(2,5-Dimethoxy-benzyl)-pyrido[2...)Show InChI InChI=1S/C16H18N6O2/c1-23-11-3-4-13(24-2)9(5-11)7-19-10-6-12-14(17)21-16(18)22-15(12)20-8-10/h3-6,8,19H,7H2,1-2H3,(H4,17,18,20,21,22) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.80E+3 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM50066494
(CHEMBL116816 | N*6*-(2,5-Dimethoxy-benzyl)-quinazo...)Show InChI InChI=1S/C17H19N5O2/c1-23-12-4-6-15(24-2)10(7-12)9-20-11-3-5-14-13(8-11)16(18)22-17(19)21-14/h3-8,20H,9H2,1-2H3,(H4,18,19,21,22) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.60E+3 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM50066494
(CHEMBL116816 | N*6*-(2,5-Dimethoxy-benzyl)-quinazo...)Show InChI InChI=1S/C17H19N5O2/c1-23-12-4-6-15(24-2)10(7-12)9-20-11-3-5-14-13(8-11)16(18)22-17(19)21-14/h3-8,20H,9H2,1-2H3,(H4,18,19,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.10E+4 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair | |
Dihydrofolate reductase
(Pneumocystis carinii) | BDBM18069
(5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-d...)Show InChI InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18) | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
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| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| n/a | n/a | 1.20E+4 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Dihydrofolate reductase
(Rattus norvegicus (rat)) | BDBM18069
(5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-d...)Show InChI InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| n/a | n/a | 1.33E+5 | 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 51: 6195-200 (2008)
Article DOI: 10.1021/jm800694g
BindingDB Entry DOI: 10.7270/Q2BP03PT |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
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