Found 3 hits for monomerid = 50136950 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, brain
(Homo sapiens (Human)-Rattus norvegicus (rat)) | BDBM50136950
(CHEMBL446171 | N-{4-[4-((S)-6-Hydroxy-2,5,7,8-tetr...)Show SMILES Cc1c(C)c2O[C@@](C)(CCc2c(C)c1O)C(=O)C1CCC(CC1)c1ccc(cc1)N=C(N)c1cccs1 |w:29.32,wU:6.16,wD:6.6,(13.73,-2.01,;12.4,-2.78,;11.06,-2.01,;11.04,-.47,;9.74,-2.78,;8.41,-2.01,;7.07,-2.78,;7.05,-1.24,;7.05,-4.32,;8.38,-5.11,;9.73,-4.34,;11.06,-5.11,;11.06,-6.65,;12.4,-4.34,;13.73,-5.11,;5.74,-2.01,;5.75,-.47,;4.39,-2.76,;4.39,-4.29,;3.04,-5.05,;1.71,-4.27,;1.73,-2.73,;3.06,-1.97,;.37,-5.02,;-.95,-4.23,;-2.29,-4.99,;-2.31,-6.53,;-.97,-7.31,;.36,-6.56,;-3.66,-7.29,;-4.98,-6.51,;-4.96,-4.97,;-6.31,-7.26,;-6.5,-8.8,;-8,-9.11,;-8.76,-7.77,;-7.74,-6.63,)| Show InChI InChI=1S/C31H36N2O3S/c1-18-19(2)28-25(20(3)27(18)34)15-16-31(4,36-28)29(35)23-9-7-21(8-10-23)22-11-13-24(14-12-22)33-30(32)26-6-5-17-37-26/h5-6,11-14,17,21,23,34H,7-10,15-16H2,1-4H3,(H2,32,33)/t21?,23?,31-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 920 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University
Curated by ChEMBL
| Assay Description Inhibitory activity against neuronal nitric oxide synthase |
J Med Chem 46: 5700-11 (2003)
Checked by Author Article DOI: 10.1021/jm030301u BindingDB Entry DOI: 10.7270/Q26D5TQV |
More data for this Ligand-Target Pair | |
Nitric oxide synthase, endothelial
(Homo sapiens (Human)-Bos taurus (bovine)) | BDBM50136950
(CHEMBL446171 | N-{4-[4-((S)-6-Hydroxy-2,5,7,8-tetr...)Show SMILES Cc1c(C)c2O[C@@](C)(CCc2c(C)c1O)C(=O)C1CCC(CC1)c1ccc(cc1)N=C(N)c1cccs1 |w:29.32,wU:6.16,wD:6.6,(13.73,-2.01,;12.4,-2.78,;11.06,-2.01,;11.04,-.47,;9.74,-2.78,;8.41,-2.01,;7.07,-2.78,;7.05,-1.24,;7.05,-4.32,;8.38,-5.11,;9.73,-4.34,;11.06,-5.11,;11.06,-6.65,;12.4,-4.34,;13.73,-5.11,;5.74,-2.01,;5.75,-.47,;4.39,-2.76,;4.39,-4.29,;3.04,-5.05,;1.71,-4.27,;1.73,-2.73,;3.06,-1.97,;.37,-5.02,;-.95,-4.23,;-2.29,-4.99,;-2.31,-6.53,;-.97,-7.31,;.36,-6.56,;-3.66,-7.29,;-4.98,-6.51,;-4.96,-4.97,;-6.31,-7.26,;-6.5,-8.8,;-8,-9.11,;-8.76,-7.77,;-7.74,-6.63,)| Show InChI InChI=1S/C31H36N2O3S/c1-18-19(2)28-25(20(3)27(18)34)15-16-31(4,36-28)29(35)23-9-7-21(8-10-23)22-11-13-24(14-12-22)33-30(32)26-6-5-17-37-26/h5-6,11-14,17,21,23,34H,7-10,15-16H2,1-4H3,(H2,32,33)/t21?,23?,31-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| 1.10E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University
Curated by ChEMBL
| Assay Description Inhibitory activity against endothelial nitric oxide synthase (eNOS) |
J Med Chem 46: 5700-11 (2003)
Checked by Author Article DOI: 10.1021/jm030301u BindingDB Entry DOI: 10.7270/Q26D5TQV |
More data for this Ligand-Target Pair | |
Nitric oxide synthase, inducible
(Mus musculus (mouse)-Homo sapiens (Human)) | BDBM50136950
(CHEMBL446171 | N-{4-[4-((S)-6-Hydroxy-2,5,7,8-tetr...)Show SMILES Cc1c(C)c2O[C@@](C)(CCc2c(C)c1O)C(=O)C1CCC(CC1)c1ccc(cc1)N=C(N)c1cccs1 |w:29.32,wU:6.16,wD:6.6,(13.73,-2.01,;12.4,-2.78,;11.06,-2.01,;11.04,-.47,;9.74,-2.78,;8.41,-2.01,;7.07,-2.78,;7.05,-1.24,;7.05,-4.32,;8.38,-5.11,;9.73,-4.34,;11.06,-5.11,;11.06,-6.65,;12.4,-4.34,;13.73,-5.11,;5.74,-2.01,;5.75,-.47,;4.39,-2.76,;4.39,-4.29,;3.04,-5.05,;1.71,-4.27,;1.73,-2.73,;3.06,-1.97,;.37,-5.02,;-.95,-4.23,;-2.29,-4.99,;-2.31,-6.53,;-.97,-7.31,;.36,-6.56,;-3.66,-7.29,;-4.98,-6.51,;-4.96,-4.97,;-6.31,-7.26,;-6.5,-8.8,;-8,-9.11,;-8.76,-7.77,;-7.74,-6.63,)| Show InChI InChI=1S/C31H36N2O3S/c1-18-19(2)28-25(20(3)27(18)34)15-16-31(4,36-28)29(35)23-9-7-21(8-10-23)22-11-13-24(14-12-22)33-30(32)26-6-5-17-37-26/h5-6,11-14,17,21,23,34H,7-10,15-16H2,1-4H3,(H2,32,33)/t21?,23?,31-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| >3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Northwestern University
Curated by ChEMBL
| Assay Description Inhibitory activity against Inducible nitric oxide synthase |
J Med Chem 46: 5700-11 (2003)
Checked by Author Article DOI: 10.1021/jm030301u BindingDB Entry DOI: 10.7270/Q26D5TQV |
More data for this Ligand-Target Pair | |