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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50044878   
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
3-oxo-5-alpha-steroid 4-dehydrogenase 1


(Homo sapiens (Human))
BDBM50044878
PNG
(4,8-Dimethyl-1,4,4a,5,6,10b-hexahydro-2H-benzo[f]q...)
Show SMILES CN1[C@@H]2CCc3cc(C)ccc3[C@H]2CCC1=O
Show InChI InChI=1S/C15H19NO/c1-10-3-5-12-11(9-10)4-7-14-13(12)6-8-15(17)16(14)2/h3,5,9,13-14H,4,6-8H2,1-2H3/t13-,14-/m1/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 11n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro inhibition of DHT production in Hs 68 (human genital fibroblast) cells.


J Med Chem 36: 421-3 (1993)


BindingDB Entry DOI: 10.7270/Q2T43TQX
More data for this
Ligand-Target Pair
3-oxo-5-alpha-steroid 4-dehydrogenase 1


(Homo sapiens (Human))
BDBM50044878
PNG
(4,8-Dimethyl-1,4,4a,5,6,10b-hexahydro-2H-benzo[f]q...)
Show SMILES CN1[C@@H]2CCc3cc(C)ccc3[C@H]2CCC1=O
Show InChI InChI=1S/C15H19NO/c1-10-3-5-12-11(9-10)4-7-14-13(12)6-8-15(17)16(14)2/h3,5,9,13-14H,4,6-8H2,1-2H3/t13-,14-/m1/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 32n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration required to inhibit Steroid 5-alpha-reductase type 1 in cultured Hs 68 human foreskin fibroblast cells


Bioorg Med Chem Lett 3: 1157-1162 (1993)


Article DOI: 10.1016/S0960-894X(00)80306-6
BindingDB Entry DOI: 10.7270/Q2VD70NP
More data for this
Ligand-Target Pair