Estradiol Cypionate

Estradiol Cypionate

SCHEMBL7180612

C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1.C[C@]12CC[C@@H]3c4ccc(OC(=O)c5ccccc5)cc4CC[C@H]3[C@@H]1CC[C@@H]2O

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ESR1

The experimentally established mechanism targets of Estradiol Cypionate. 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
ESR1 known ✓ P03372 7/20 0.74
LMNA P02545 10/20 0.74
KMT2A Q03164 8/20 0.74
MAPT P10636 8/20 0.74
CYP3A4 P08684 7/20 0.74
MEN1 O00255 6/20 0.74
ADORA3 P0DMS8 4/20 0.74
TP53 P04637 4/20 0.74
PGR P06401 4/20 0.74
AR P10275 4/20 0.74
MAPK1 P28482 3/20 0.74
PTGS1 P23219 2/20 0.74
PDE3A Q14432 2/20 0.74
CYP2C19 P33261 2/20 0.74
PDE4A P27815 1/20 0.74
SMN1; SMN2 Q16637 6/20 0.70
ATM Q13315 3/20 0.70
NR3C1 P04150 2/20 0.70
SHBG P04278 2/20 0.70
SLC6A4 P31645 2/20 0.70

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
Estradiol Cypionate SCHEMBL6195927 0.90 LMNA (0.92) LMNAKMT2AMAPTCYP3A4ESR1
Estradiol Cypionate SCHEMBL3199191 0.89 LMNA (0.87) LMNAKMT2AMAPTCYP3A4ESR1
Estradiol Benzoate SCHEMBL5885955 0.87 ESR1 (0.93) LMNAKMT2AMAPTCYP3A4ESR1
Estradiol Cypionate SCHEMBL28333106 0.86 LMNA (1.00) LMNAKMT2AMAPTCYP3A4ESR1
Estradiol Cypionate SCHEMBL12754433 0.86 LMNA (1.00) LMNAKMT2AMAPTCYP3A4ESR1
Estradiol Cypionate SCHEMBL29404977 0.86 LMNA (1.00) LMNAKMT2AMAPTCYP3A4ESR1
Estradiol Cypionate SCHEMBL41551 0.86 LMNA (1.00) LMNAKMT2AMAPTCYP3A4ESR1
Estradiol Cypionate SCHEMBL19236258 0.86 LMNA (1.00) LMNAKMT2AMAPTCYP3A4ESR1
Estradiol Cypionate SCHEMBL20130822 0.86 LMNA (1.00) LMNAKMT2AMAPTCYP3A4ESR1
SCHEMBL4649449 0.85 MAPT (0.82) LMNAKMT2AMAPTCYP3A4ESR1

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
EP-0748190-B1 PROGESTOGEN-FREE FORMULATIONS OF GnRH AND ESTROGEN FOR TREATING BENIGN GYNECOLOGICAL DISORDERS UNIV SOUTHERN CALIFORNIA (US) 2003-07-30 EP claimed