BindingDB

null

SMILES C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3C=C[C@]12C

InChI Key InChIKey=CCCIJQPRIXGQOE-XWSJACJDSA-N

PDB links: 5 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50367916

Androgen receptor(Rattus norvegicus (Rat))
University of Basel

Curated by ChEMBL

BDBM50367916(METHYLTRIENOLONE | Metribolone | R-1881)copy SMILEScopy InChI

IC50: 3.09nMAssay Description:Inhibitory concentration against recombinant rat androgen receptor expressed in Escherichia coli using [3H]methyltrienolone (R 1881)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar

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Details Article
BindingDB Entry DOI: 10.7270/Q2TM7CBZPubMed MMDB
PDB

3D Structure (crystal)

Targets 5 ▿
- Androgen receptor 19
- Sex hormone-binding globulin 1
- Mineralocorticoid receptor 1
- Glucocorticoid receptor 1
- Progesterone receptor 1
Publications 9 ▿
- J Med Chem 48: 2026-35 (2005) 9
- J Med Chem 59: 750-5 (2016) 5
- Eur J Med Chem 171: 265-281 (2019) 1
- Bioorg Med Chem Lett 20: 7516-20 (2010) 1
- J Med Chem 48: 5666-74 (2005) 1
- Bioorg Med Chem Lett 16: 3233-7 (2006) 1
- J Med Chem 33: 129-32 (1990) 1
- Eur J Med Chem 157: 791-804 (2018) 1
- J Med Chem 53: 3349-60 (2010) 1
Institutions 9 ▿
- [University of Ferrara] 9
- [Lilly Research Laboratories] 5
- [University of Basel, Marquette University, Sterling Research Group, Sichuan University and Collaborative Innovation Center for Biotherapy, Johnson& Johnson Pharmaceutical Research and Development, University of Illinois, Radius Health, Inc.] 1
- [University of Basel, Marquette University, Sterling Research Group, Sichuan University and Collaborative Innovation Center for Biotherapy, Johnson& Johnson Pharmaceutical Research and Development, University of Illinois, Radius Health, Inc.] 1
- [University of Basel, Marquette University, Sterling Research Group, Sichuan University and Collaborative Innovation Center for Biotherapy, Johnson& Johnson Pharmaceutical Research and Development, University of Illinois, Radius Health, Inc.] 1
- [University of Basel, Marquette University, Sterling Research Group, Sichuan University and Collaborative Innovation Center for Biotherapy, Johnson& Johnson Pharmaceutical Research and Development, University of Illinois, Radius Health, Inc.] 1
- [University of Basel, Marquette University, Sterling Research Group, Sichuan University and Collaborative Innovation Center for Biotherapy, Johnson& Johnson Pharmaceutical Research and Development, University of Illinois, Radius Health, Inc.] 1
- [University of Basel, Marquette University, Sterling Research Group, Sichuan University and Collaborative Innovation Center for Biotherapy, Johnson& Johnson Pharmaceutical Research and Development, University of Illinois, Radius Health, Inc.] 1
- [University of Basel, Marquette University, Sterling Research Group, Sichuan University and Collaborative Innovation Center for Biotherapy, Johnson& Johnson Pharmaceutical Research and Development, University of Illinois, Radius Health, Inc.] 1
Affinity: 0.013 to 9.7 nM▿
- Ki 4
- IC50 7
- Kd 10
- EC50 2
- Affinity ≤ nM
Xtal structures: 1
Docked structures: 0
Catalog Cmpds: 1