Found 3 hits with Last Name = 'abou-mansour' and Initial = 'e' 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 |
|---|
Nitric oxide synthase, brain
(Rattus norvegicus (rat)) | BDBM50414551
(CHEMBL2021445 | EUSYNSTYELAMIDE B)Show SMILES NC(N)=NCCCCNC(=O)[C@@]1(O)[C@H](Cc2c[nH]c3cc(Br)ccc23)[C@@](O)(Cc2c[nH]c3cc(Br)ccc23)C(=O)N1CCCCN=C(N)N |r,wU:11.10,25.28,wD:13.13,25.27,11.11,(16.15,-36.99,;15.31,-35.7,;16.01,-34.33,;13.77,-35.78,;12.93,-34.49,;11.39,-34.57,;10.56,-33.28,;9.02,-33.36,;8.18,-32.07,;6.64,-32.15,;5.94,-33.52,;5.8,-30.85,;7.29,-30.46,;4.32,-31.25,;4.23,-32.79,;3.15,-33.88,;4.68,-34.04,;5,-35.55,;3.66,-36.32,;3.34,-37.82,;1.88,-38.3,;1.48,-39.79,;.73,-37.27,;1.05,-35.76,;2.52,-35.29,;3.48,-29.96,;2.71,-28.63,;1.94,-29.88,;1.17,-31.21,;1.8,-32.62,;.65,-33.65,;-.68,-32.88,;-2.15,-33.36,;-3.29,-32.33,;-4.76,-32.8,;-2.97,-30.82,;-1.51,-30.35,;-.36,-31.38,;4.45,-28.76,;4.05,-27.28,;5.88,-29.32,;7.18,-28.48,;8.51,-29.25,;9.84,-28.48,;11.18,-29.25,;12.51,-28.48,;13.84,-29.25,;15.18,-28.48,;13.84,-30.79,)| Show InChI InChI=1S/C33H42Br2N10O4/c34-21-5-7-23-19(17-43-25(23)14-21)13-27-32(48,16-20-18-44-26-15-22(35)6-8-24(20)26)29(47)45(12-4-3-11-42-31(38)39)33(27,49)28(46)40-9-1-2-10-41-30(36)37/h5-8,14-15,17-18,27,43-44,48-49H,1-4,9-13,16H2,(H,40,46)(H4,36,37,41)(H4,38,39,42)/t27-,32+,33+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Marine Science
Curated by ChEMBL
| Assay Description
Inhibition of rat cerebella nNOS synthase assessed as [3H]arginine to [3H]citrulline conversion by microbeta scintillation counting |
J Nat Prod 72: 1115-20 (2009)
Article DOI: 10.1021/np900099j
BindingDB Entry DOI: 10.7270/Q2J966DT |
More data for this
Ligand-Target Pair | |
Nitric oxide synthase, brain
(Rattus norvegicus (rat)) | BDBM50414552
(CHEMBL2021548)Show SMILES NC(N)=NCCCCNC(=O)[C@@]1(O)[C@H](Cc2c[nH]c3cc(Br)ccc23)[C@](O)(Cc2c[nH]c3cc(Br)ccc23)C(=O)N1CCCCN=C(N)N |r,wU:11.10,25.27,wD:13.13,25.28,11.11,(16.15,-36.99,;15.31,-35.7,;16.01,-34.33,;13.77,-35.78,;12.93,-34.49,;11.39,-34.57,;10.56,-33.28,;9.02,-33.36,;8.18,-32.07,;6.64,-32.15,;5.94,-33.52,;5.8,-30.85,;7.29,-30.46,;4.32,-31.25,;4.23,-32.79,;3.15,-33.88,;4.68,-34.04,;5,-35.55,;3.66,-36.32,;3.34,-37.82,;1.88,-38.3,;1.48,-39.79,;.73,-37.27,;1.05,-35.76,;2.52,-35.29,;3.48,-29.96,;2.71,-28.63,;1.94,-29.88,;1.17,-31.21,;1.8,-32.62,;.65,-33.65,;-.68,-32.88,;-2.15,-33.36,;-3.29,-32.33,;-4.76,-32.8,;-2.97,-30.82,;-1.51,-30.35,;-.36,-31.38,;4.45,-28.76,;4.05,-27.28,;5.88,-29.32,;7.18,-28.48,;8.51,-29.25,;9.84,-28.48,;11.18,-29.25,;12.51,-28.48,;13.84,-29.25,;15.18,-28.48,;13.84,-30.79,)| Show InChI InChI=1S/C33H42Br2N10O4/c34-21-5-7-23-19(17-43-25(23)14-21)13-27-32(48,16-20-18-44-26-15-22(35)6-8-24(20)26)29(47)45(12-4-3-11-42-31(38)39)33(27,49)28(46)40-9-1-2-10-41-30(36)37/h5-8,14-15,17-18,27,43-44,48-49H,1-4,9-13,16H2,(H,40,46)(H4,36,37,41)(H4,38,39,42)/t27-,32-,33+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Marine Science
Curated by ChEMBL
| Assay Description
Inhibition of rat cerebella nNOS synthase assessed as [3H]arginine to [3H]citrulline conversion by microbeta scintillation counting |
J Nat Prod 72: 1115-20 (2009)
Article DOI: 10.1021/np900099j
BindingDB Entry DOI: 10.7270/Q2J966DT |
More data for this
Ligand-Target Pair | |
Nitric oxide synthase, brain
(Rattus norvegicus (rat)) | BDBM50414553
(CHEMBL2021444 | EUSYNSTYELAMIDE A)Show SMILES NC(N)=NCCCCNC(=O)[C@]1(O)[C@H](Cc2c[nH]c3cc(Br)ccc23)[C@@](O)(Cc2c[nH]c3cc(Br)ccc23)C(=O)N1CCCCN=C(N)N |r,wU:25.28,11.11,wD:13.13,11.10,25.27,(16.15,-36.99,;15.31,-35.7,;16.01,-34.33,;13.77,-35.78,;12.93,-34.49,;11.39,-34.57,;10.56,-33.28,;9.02,-33.36,;8.18,-32.07,;6.64,-32.15,;5.94,-33.52,;5.8,-30.85,;7.29,-30.46,;4.32,-31.25,;4.23,-32.79,;3.15,-33.88,;4.68,-34.04,;5,-35.55,;3.66,-36.32,;3.34,-37.82,;1.88,-38.3,;1.48,-39.79,;.73,-37.27,;1.05,-35.76,;2.52,-35.29,;3.48,-29.96,;2.71,-28.63,;1.94,-29.88,;1.17,-31.21,;1.8,-32.62,;.65,-33.65,;-.68,-32.88,;-2.15,-33.36,;-3.29,-32.33,;-4.76,-32.8,;-2.97,-30.82,;-1.51,-30.35,;-.36,-31.38,;4.45,-28.76,;4.05,-27.28,;5.88,-29.32,;7.18,-28.48,;8.51,-29.25,;9.84,-28.48,;11.18,-29.25,;12.51,-28.48,;13.84,-29.25,;15.18,-28.48,;13.84,-30.79,)| Show InChI InChI=1S/C33H42Br2N10O4/c34-21-5-7-23-19(17-43-25(23)14-21)13-27-32(48,16-20-18-44-26-15-22(35)6-8-24(20)26)29(47)45(12-4-3-11-42-31(38)39)33(27,49)28(46)40-9-1-2-10-41-30(36)37/h5-8,14-15,17-18,27,43-44,48-49H,1-4,9-13,16H2,(H,40,46)(H4,36,37,41)(H4,38,39,42)/t27-,32+,33-/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.17E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Marine Science
Curated by ChEMBL
| Assay Description
Inhibition of rat cerebella nNOS synthase assessed as [3H]arginine to [3H]citrulline conversion by microbeta scintillation counting |
J Nat Prod 72: 1115-20 (2009)
Article DOI: 10.1021/np900099j
BindingDB Entry DOI: 10.7270/Q2J966DT |
More data for this
Ligand-Target Pair | |
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