Fluocinolone Acetonide

Fluocinolone Acetonide

SCHEMBL15568127

CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@]2(C(=O)CO)O1.CCCC(=O)O[C@]1(C(=O)CO)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C.C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C1

The experimentally established mechanism targets of Fluocinolone Acetonide. 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 6/20 0.57
▸ HIF1A Q16665 9/20 0.57
▸ LMNA P02545 6/20 0.57
▸ PGR P06401 5/20 0.57
▸ NR3C2 P08235 4/20 0.57
▸ AR P10275 3/20 0.57
▸ CYP3A4 P08684 3/20 0.57
▸ MAPT P10636 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ KMT2A Q03164 2/20 0.54
▸ NPSR1 Q6W5P4 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ NR1I2 O75469 1/20 0.50
▸ ABCB11 O95342 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ CYP2C19 P33261 1/20 0.48

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
Fluocinonide SCHEMBL15568196 0.96 HIF1A (0.58) HIF1ALMNANR3C1PGRNR3C2
Fluocinolone Acetonide SCHEMBL8451856 0.87 NR3C1 (0.60) HIF1ALMNANR3C1PGRNR3C2
Fluocinonide SCHEMBL5664031 0.85 NR3C1 (0.62) HIF1ALMNANR3C1PGRAR
Difluprednate SCHEMBL20270247 0.85 HIF1A (0.72) HIF1ALMNANR3C1PGRNR3C2
Difluprednate SCHEMBL4959751 0.83 LMNA (0.66) HIF1ALMNANR3C1PGRNR3C2
Prednicarbate SCHEMBL6470591 0.81 NR3C1 (0.57) HIF1ALMNANR3C1PGRAR
Halobetasol Propionate SCHEMBL4633197 0.80 PGR (0.62) HIF1ALMNANR3C1PGRNR3C2
Hydrocortisone Butyrate SCHEMBL6835762 0.79 NR3C2 (0.91) HIF1ALMNANR3C1PGRNR3C2
Hydrocortisone Butyrate SCHEMBL9838663 0.79 NR3C2 (0.91) HIF1ALMNANR3C1PGRNR3C2
Fluocinolone Acetonide SCHEMBL8450831 0.79 NR3C1 (0.77) HIF1ALMNANR3C1PGRNR3C2

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
WO-2014027006-A1 BIOADHESIVE FORMULATIONS FOR USE IN DRUG DELIVERY EDKO PAZARLAMA TANITIM TICARET LIMITED SIRKETI (TR) 2014-02-20 — — WO disclosed
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