BDBM91713 Androst-4-en-3,17-dione, 2::Androst-4-ene-3,17-dione (3)::Androstenedione

SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O

InChI Key InChIKey=AEMFNILZOJDQLW-QAGGRKNESA-N

Data  2 KI  14 IC50  1 Kd

PDB links: 28 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 91713   

TargetCorticosteroid-binding globulin(Homo sapiens)
Nippon Zoki Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataKi:  1.74E+3nMAssay Description:Binding affinity to human CBG receptor (corticosteroid-binding globulins)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSolute carrier organic anion transporter family member(Danio rerio (Zebrafish))
Rudjer Boskovic Institute

LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataKi:  3.78E+3nMAssay Description:In the inhibition experiments, the cells were preincubated for 20 s with test compounds, followed by a 5-min incubation with [3H]E3S (5 nM) or 30-min...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target3-oxo-5-alpha-steroid 4-dehydrogenase 2(Homo sapiens (Human))
Chul Research Center

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  84nMAssay Description:In vitro inhibition of human Steroid 5-alpha-reductase type 2 in transfected SW-13 cells using [3H]- delta4-Androstenedione as substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target3-oxo-5-alpha-steroid 4-dehydrogenase 1(Homo sapiens (Human))
Chul Research Center

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  2.70E+3nMAssay Description:In vitro inhibition of human tSteroid 5-alpha-reductase type I in transfected 293 cells using [3H]- delta4-Androstenedione as substrate.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target17-beta-hydroxysteroid dehydrogenase type 3(Rattus norvegicus)
Chu De Qu£Bec-Research Center (Chul)

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  169nMAssay Description:Inhibition of 17beta-HSD3 in rat testes microsomes using [14C]-4-androstene-3,17-dione as substrate after 2 hrsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target17-beta-hydroxysteroid dehydrogenase type 3(Homo sapiens (Human))
Laval University

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  758nMAssay Description:Inhibitory concentration against type-3 17-beta-HSD expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAndrogen receptor(Rattus norvegicus (Rat))
TBA

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  64nMAssay Description:In vitro antagonist activity against rat prostatic androgen receptor (AR)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAlpha-synuclein(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  8.59E+4nMAssay Description:Inhibition of alpha-synuclein aggregation (unknown origin) incubated for 8 days by thioflavin S based fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target17-beta-hydroxysteroid dehydrogenase type 3(Homo sapiens (Human))
Laval University

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  758nMAssay Description:Ability to inhibit the Type-3 17-beta- hydroxysteroid dehydrogenase activity transfected in human embryonic kidney (HEK)-293 cells experiment 1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target17-beta-hydroxysteroid dehydrogenase type 3(Homo sapiens (Human))
Laval University

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  489nMAssay Description:Ability to inhibit the Type-3 17-beta- hydroxysteroid dehydrogenase activity transfected in human embryonic kidney (HEK)-293 cells experiment 3More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target17-beta-hydroxysteroid dehydrogenase type 3(Homo sapiens (Human))
Laval University

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  758nMAssay Description:Inhibition of type-3 17 beta-hydroxysteroid dehydrogenase expressed in HEK293 cells at 37 degree C pH7.4 More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSex hormone-binding globulin(Homo sapiens (Human))
University Of British Columbia

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataKd:  35nMAssay Description:Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAndrogen receptor(Rattus norvegicus (Rat))
TBA

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  1.29E+3nMAssay Description:Inhibitory concentration against recombinant rat androgen receptor expressed in Escherichia coli using [3H]methyltrienolone (R 1881)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetReverse transcriptase(Human immunodeficiency virus 1)
University Of Illinois

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50: >6.98E+5nMAssay Description:Inhibition of HIV1 RTMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-glucuronidase(Escherichia coli (Enterobacteria))
University Of Karachi

LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  4.30E+5nMpH: 7.0 T: 2°CAssay Description:β-Glucuronidase inhibitory activity was evaluated by a biochemical assay, based on the measurement of the absorbance of p-nitrophenol at 405 nm,...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCholinesterase(Homo sapiens (Human))
University Of Jordan

LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  1.55E+3nMAssay Description:AChE and BChE inhibiting activities were measured in vitro by a modified spectrophotometric method previously developed by Ellman et. al.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target17-beta-hydroxysteroid dehydrogenase type 3(Homo sapiens (Human))
Laval University

Curated by ChEMBL
LigandPNGBDBM91713(Androst-4-en-3,17-dione, 2 | Androst-4-ene-3,17-di...)
Affinity DataIC50:  650nMAssay Description:Ability to inhibit the Type-3 17-beta- hydroxysteroid dehydrogenase activity transfected in human embryonic kidney (HEK)-293 cells experiment 2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed