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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Dehydrogenase/reductase SDR family member 9' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Dehydrogenase/reductase SDR family member 9


(Homo sapiens)
BDBM17638
PNG
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)
Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1
Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
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Article
PubMed
n/an/a 1.40E+4n/an/an/an/an/an/a



Institute for Natural Product Research and Infection Biology

Curated by ChEMBL


Assay Description
Inhibition of 3alphaHSD


Citation and Details
More data for this
Ligand-Target Pair
Dehydrogenase/reductase SDR family member 9


(Homo sapiens)
BDBM50371115
PNG
(CHEMBL232615)
Show SMILES C[C@]1(CO)Oc2ccc(O)cc2C=C1
Show InChI InChI=1S/C11H12O3/c1-11(7-12)5-4-8-6-9(13)2-3-10(8)14-11/h2-6,12-13H,7H2,1H3/t11-/m0/s1
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CHEMBL
PC cid
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Article
PubMed
n/an/a 1.14E+5n/an/an/an/an/an/a



Institute for Natural Product Research and Infection Biology

Curated by ChEMBL


Assay Description
Inhibition of 3alphaHSD


Citation and Details
More data for this
Ligand-Target Pair
Dehydrogenase/reductase SDR family member 9


(Homo sapiens)
BDBM50359629
PNG
(TROLOX)
Show SMILES Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(O)=O
Show InChI InChI=1S/C14H18O4/c1-7-8(2)12-10(9(3)11(7)15)5-6-14(4,18-12)13(16)17/h15H,5-6H2,1-4H3,(H,16,17)
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PC cid
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Article
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



Institute for Natural Product Research and Infection Biology

Curated by ChEMBL


Assay Description
Inhibition of 3alphaHSD


Citation and Details
More data for this
Ligand-Target Pair