Epitestosterone

Epitestosterone

SCHEMBL17808819

CC12CCC3C(CCC4=CC(=O)CC[C@@]43C)C1CC[C@@H]2O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

AR

The experimentally established mechanism targets of Epitestosterone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR known ✓ P10275 6/20 1.00
LMNA P02545 5/20 1.00
CYP3A4 P08684 5/20 1.00
SHBG P04278 5/20 1.00
CYP19A1 P11511 4/20 1.00
TSHR P16473 4/20 1.00
MAPT P10636 4/20 1.00
HSD17B10 Q99714 3/20 1.00
NR3C1 P04150 3/20 1.00
PGR P06401 3/20 1.00
SERPINA6 P08185 3/20 1.00
GPBAR1 Q8TDU6 3/20 1.00
SIGMAR1 Q99720 3/20 1.00
MAPK1 P28482 3/20 1.00
SNCA P37840 2/20 1.00
CACNA1C Q13936 2/20 1.00
CYP51A1 Q16850 2/20 1.00
OR51E2 Q9H255 1/20 1.00
ESR2 Q92731 3/20 0.73
ESR1 P03372 1/20 0.73

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Epitestosterone SCHEMBL14034478 1.00 AR (1.00) ARLMNACYP3A4SHBGCYP19A1
Epitestosterone SCHEMBL617693 1.00 AR (1.00) ARLMNACYP3A4SHBGCYP19A1
Testosterone SCHEMBL145157 1.00 AR (1.00) ARLMNACYP3A4SHBGCYP19A1
Epitestosterone SCHEMBL16305625 1.00 AR (1.00) ARLMNACYP3A4SHBGCYP19A1
Epitestosterone SCHEMBL13752937 1.00 AR (1.00) ARLMNACYP3A4SHBGCYP19A1
Epitestosterone SCHEMBL11588466 1.00 AR (1.00) ARLMNACYP3A4SHBGCYP19A1
Epitestosterone SCHEMBL2678780 1.00 AR (1.00) ARLMNACYP3A4SHBGCYP19A1
Epitestosterone SCHEMBL12367194 1.00 AR (1.00) ARLMNACYP3A4SHBGCYP19A1
Epitestosterone SCHEMBL21957465 1.00 AR (1.00) ARLMNACYP3A4SHBGCYP19A1
Epitestosterone SCHEMBL22704809 1.00 AR (1.00) ARLMNACYP3A4SHBGCYP19A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160159731-A1 Bifunctional AKR1C3 Inhibitors/Androgen Receptor Modulators and Methods of Use Thereof UNIV PENNSYLVANIA (US) 2016-06-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160159731-A1 Bifunctional AKR1C3 Inhibitors/Androgen Receptor Modulators and Methods of Use Thereof AR, AKR1C3, AKR1C2 AR 1/4885LMNA 3802/4885CYP3A4 162/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.