Found 4 hits for monomerid = 50330897 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 |
Nitric Oxide Synthase, inducible
(Mus musculus (mouse)) | BDBM50330897
(6-(((3R,4S)-4-(2-(4-fluorobenzylamino)ethoxy)pyrro...)Show SMILES Cc1cc(N)nc(C[C@H]2CNC[C@@H]2OCCNCCc2cccc(F)c2)c1 |r| Show InChI InChI=1S/C21H29FN4O/c1-15-9-19(26-21(23)10-15)12-17-13-25-14-20(17)27-8-7-24-6-5-16-3-2-4-18(22)11-16/h2-4,9-11,17,20,24-25H,5-8,12-14H2,1H3,(H2,23,26)/t17-,20-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| Article PubMed
| 63 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University
Curated by ChEMBL
| Assay Description Inhibition of mouse recombinant iNOS |
J Med Chem 53: 7804-24 (2010)
Article DOI: 10.1021/jm100947x BindingDB Entry DOI: 10.7270/Q2NC61FT |
More data for this Ligand-Target Pair | |
Nitric Oxide Synthase, inducible
(Mus musculus (mouse)) | BDBM50330897
(6-(((3R,4S)-4-(2-(4-fluorobenzylamino)ethoxy)pyrro...)Show SMILES Cc1cc(N)nc(C[C@H]2CNC[C@@H]2OCCNCCc2cccc(F)c2)c1 |r| Show InChI InChI=1S/C21H29FN4O/c1-15-9-19(26-21(23)10-15)12-17-13-25-14-20(17)27-8-7-24-6-5-16-3-2-4-18(22)11-16/h2-4,9-11,17,20,24-25H,5-8,12-14H2,1H3,(H2,23,26)/t17-,20-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| Article PubMed
| 6.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University
Curated by ChEMBL
| Assay Description Inhibition of mouse recombinant iNOS |
J Med Chem 53: 7804-24 (2010)
Article DOI: 10.1021/jm100947x BindingDB Entry DOI: 10.7270/Q2NC61FT |
More data for this Ligand-Target Pair | |
Nitric-oxide synthase, brain
(Rattus norvegicus (rat)) | BDBM50330897
(6-(((3R,4S)-4-(2-(4-fluorobenzylamino)ethoxy)pyrro...)Show SMILES Cc1cc(N)nc(C[C@H]2CNC[C@@H]2OCCNCCc2cccc(F)c2)c1 |r| Show InChI InChI=1S/C21H29FN4O/c1-15-9-19(26-21(23)10-15)12-17-13-25-14-20(17)27-8-7-24-6-5-16-3-2-4-18(22)11-16/h2-4,9-11,17,20,24-25H,5-8,12-14H2,1H3,(H2,23,26)/t17-,20-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| 1.87E+7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University
Curated by ChEMBL
| Assay Description Inhibition of rat recombinant nNOS |
J Med Chem 53: 7804-24 (2010)
Article DOI: 10.1021/jm100947x BindingDB Entry DOI: 10.7270/Q2NC61FT |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Nitric Oxide Synthase, endothelial
(Bos taurus (bovine)) | BDBM50330897
(6-(((3R,4S)-4-(2-(4-fluorobenzylamino)ethoxy)pyrro...)Show SMILES Cc1cc(N)nc(C[C@H]2CNC[C@@H]2OCCNCCc2cccc(F)c2)c1 |r| Show InChI InChI=1S/C21H29FN4O/c1-15-9-19(26-21(23)10-15)12-17-13-25-14-20(17)27-8-7-24-6-5-16-3-2-4-18(22)11-16/h2-4,9-11,17,20,24-25H,5-8,12-14H2,1H3,(H2,23,26)/t17-,20-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| 3.62E+7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University
Curated by ChEMBL
| Assay Description Inhibition of bovine recombinant eNOS |
J Med Chem 53: 7804-24 (2010)
Article DOI: 10.1021/jm100947x BindingDB Entry DOI: 10.7270/Q2NC61FT |
More data for this Ligand-Target Pair | 3D Structure (crystal) |