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Compile Data Set for Download or QSAR

Found 2 hits of kd data for polymerid = 3611   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Nitric oxide synthase, brain


(Homo sapiens (Human))
BDBM50373697
PNG
(Sapropterin | TETRAHYDROBIOPTERIN)
Show SMILES C[C@H](O)[C@H](O)[C@H]1CNc2nc(N)[nH]c(=O)c2N1
Show InChI InChI=1S/C9H15N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h3-4,6,12,15-16H,2H2,1H3,(H4,10,11,13,14,17)/t3-,4+,6-/m0/s1
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KEGG
MMDB
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 1.12E+3n/an/an/an/an/a



University of Strathclyde

Curated by ChEMBL


Assay Description
Activity of tetrahydrobiopterin free nNOS


Bioorg Med Chem Lett 18: 1563-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.079
BindingDB Entry DOI: 10.7270/Q2V40W2D
More data for this
Ligand-Target Pair
Nitric oxide synthase, brain


(Homo sapiens (Human))
BDBM50373696
PNG
(CHEMBL403871)
Show SMILES CC(=O)C1Nc2c(NC1(C)C)nc(N)[nH]c2=O
Show InChI InChI=1S/C10H15N5O2/c1-4(16)6-10(2,3)15-7-5(12-6)8(17)14-9(11)13-7/h6,12H,1-3H3,(H4,11,13,14,15,17)
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MMDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 1.51E+5n/an/an/an/an/a



University of Strathclyde

Curated by ChEMBL


Assay Description
Activity of tetrahydrobiopterin free nNOS


Bioorg Med Chem Lett 18: 1563-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.079
BindingDB Entry DOI: 10.7270/Q2V40W2D
More data for this
Ligand-Target Pair