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Medroxyprogesterone Acetate

Medroxyprogesterone Acetate

SCHEMBL7723815

CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C[C@H](C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C.CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C[C@H](C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C.CCCCCC(=O)O

nearest known ligand 0.80

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PGR

The experimentally established mechanism targets of Medroxyprogesterone Acetate. 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
▸ PGR known ✓ P06401 4/20 0.80
▸ LMNA P02545 5/20 0.80
▸ NR3C1 P04150 5/20 0.80
▸ CYP3A4 P08684 4/20 0.80
▸ NPSR1 Q6W5P4 3/20 0.80
▸ SMN1; SMN2 Q16637 3/20 0.80
▸ AR P10275 3/20 0.80
▸ ABCB11 O95342 2/20 0.80
▸ ABCC4 O15439 1/20 0.80
▸ ALDH1A1 P00352 1/20 0.80
▸ ESR1 P03372 1/20 0.80
▸ SHBG P04278 1/20 0.80
▸ CHRM2 P08172 1/20 0.80
▸ NR3C2 P08235 1/20 0.80
▸ CHRM1 P11229 1/20 0.80
▸ HRH2 P25021 1/20 0.80
▸ AKR1C3 P42330 1/20 0.80
▸ AKR1C2 P52895 1/20 0.80
▸ AKR1C1 Q04828 1/20 0.80
▸ ESR2 Q92731 1/20 0.80

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
Medroxyprogesterone Acetate SCHEMBL3973884 1.00 LMNA (0.80) LMNANR3C1CYP3A4PGRNPSR1
SCHEMBL3973882 0.91 LMNA (0.75) LMNANR3C1CYP3A4PGRNPSR1
Medroxyprogesterone Acetate SCHEMBL5493761 0.90 NR3C1 (0.96) LMNANR3C1CYP3A4PGRNPSR1
Medroxyprogesterone Acetate SCHEMBL4277 0.90 NR3C1 (0.96) LMNANR3C1CYP3A4PGRNPSR1
Medroxyprogesterone Acetate SCHEMBL4556265 0.90 NR3C1 (0.96) LMNANR3C1CYP3A4PGRNPSR1
Medroxyprogesterone Acetate SCHEMBL8987454 0.90 NR3C1 (0.96) LMNANR3C1CYP3A4PGRNPSR1
Medroxyprogesterone Acetate SCHEMBL14262777 0.90 NR3C1 (1.00) LMNANR3C1CYP3A4PGRNPSR1
Medroxyprogesterone Acetate SCHEMBL6835475 0.90 NR3C1 (1.00) LMNANR3C1CYP3A4PGRNPSR1
Medroxyprogesterone Acetate SCHEMBL13941346 0.90 NR3C1 (1.00) LMNANR3C1CYP3A4PGRNPSR1
Medroxyprogesterone Acetate SCHEMBL22761990 0.90 NR3C1 (1.00) LMNANR3C1CYP3A4PGRNPSR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1221974-A2 MAGNETIC TARGETED CARRIER Ferx Incorporated (US) 2002-07-17 — — EP disclosed
WO-2001028587-A2 MAGNETIC TARGETED CARRIER FERX INCORPORATED (US) 2001-04-26 — — WO disclosed
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