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Compile Data Set for Download or QSAR

Found 3 hits with Last Name = 'abou-mansour' and Initial = 'e'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Nitric-oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50414551
PNG
(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
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/an/a 4.30E+3n/an/an/an/an/an/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
PNG
(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
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/an/a 5.80E+3n/an/an/an/an/an/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
PNG
(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
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/an/a 4.17E+4n/an/an/an/an/an/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