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Difluprednate

Difluprednate

SCHEMBL20769772

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C1

The experimentally established mechanism targets of Difluprednate. 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
▸ NR3C1 known ✓ P04150 4/20 0.64
▸ HIF1A Q16665 11/20 1.00
▸ LMNA P02545 5/20 1.00
▸ NPSR1 Q6W5P4 1/20 1.00
▸ CYP3A4 P08684 8/20 0.64
▸ PGR P06401 7/20 0.64
▸ AR P10275 6/20 0.64
▸ ALDH1A1 P00352 4/20 0.64
▸ SMN1; SMN2 Q16637 2/20 0.64
▸ CYP1A2 P05177 1/20 0.64
▸ MEN1 O00255 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ ADORA3 P0DMS8 2/20 0.54
▸ CHRM1 P11229 1/20 0.54
▸ ADRA1A P35348 1/20 0.54
▸ MAPT P10636 2/20 0.51
▸ ABCB11 O95342 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ NR1I2 O75469 2/20 0.51
▸ NR3C2 P08235 1/20 0.51

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
Difluprednate SCHEMBL5486757 1.00 HIF1A (1.00) HIF1ALMNANPSR1CYP3A4PGR
Difluprednate SCHEMBL14339608 1.00 HIF1A (1.00) HIF1ALMNANPSR1CYP3A4PGR
Difluprednate SCHEMBL19961204 1.00 HIF1A (1.00) HIF1ALMNANPSR1CYP3A4PGR
Difluprednate SCHEMBL9954379 1.00 HIF1A (1.00) HIF1ALMNANPSR1CYP3A4PGR
Difluprednate SCHEMBL5486753 1.00 HIF1A (1.00) HIF1ALMNANPSR1CYP3A4PGR
Difluprednate SCHEMBL1276671 1.00 HIF1A (1.00) HIF1ALMNANPSR1CYP3A4PGR
Difluprednate SCHEMBL23343379 1.00 HIF1A (1.00) HIF1ALMNANPSR1CYP3A4PGR
Difluprednate SCHEMBL4581 1.00 HIF1A (1.00) HIF1ALMNANPSR1CYP3A4PGR
Difluprednate SCHEMBL1276669 1.00 HIF1A (1.00) HIF1ALMNANPSR1CYP3A4PGR
Difluprednate SCHEMBL4580 1.00 HIF1A (1.00) HIF1ALMNANPSR1CYP3A4PGR

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-3675838-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS Puretecch LYT, Inc. (US) 2020-07-08 — — EP disclosed
WO-2019046491-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS ARIYA THERAPEUTICS, INC. (US) 2019-03-07 — — WO disclosed