Dexbudesonide

Dexbudesonide

SCHEMBL8423471

CCC[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@]2(C(=O)CO)O1.C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@]2(C)[C@@]1(O)C(=O)CCl

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C1

The experimentally established mechanism targets of Dexbudesonide. 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 12/20 0.70
▸ PGR P06401 6/20 0.70
▸ CYP3A4 P08684 3/20 0.70
▸ HIF1A Q16665 2/20 0.70
▸ CYP2C9 P11712 2/20 0.70
▸ ABCC3 O15438 1/20 0.70
▸ ABCC4 O15439 1/20 0.70
▸ ABCB11 O95342 1/20 0.70
▸ IL5 P05113 1/20 0.70
▸ NR3C2 P08235 1/20 0.70
▸ AR P10275 1/20 0.70
▸ CHRM1 P11229 1/20 0.70
▸ MMP9 P14780 1/20 0.70
▸ NFKB1 P19838 1/20 0.70
▸ THPO P40225 1/20 0.70
▸ SMN1; SMN2 Q16637 1/20 0.70
▸ HSD17B10 Q99714 1/20 0.70
▸ LMNA P02545 1/20 0.70
▸ BLM P54132 1/20 0.70
▸ PMP22 Q01453 1/20 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
Dexbudesonide SCHEMBL18695366 0.89 CYP3A4 (0.73) NR3C1PGRCYP3A4HIF1ACYP2C9
Dexbudesonide SCHEMBL4260550 0.89 CYP3A4 (0.73) NR3C1PGRCYP3A4HIF1ACYP2C9
Dexbudesonide SCHEMBL1302753 0.86 NR3C1 (0.73) NR3C1PGRCYP3A4HIF1ACYP2C9
Budesonide SCHEMBL20553137 0.84 NR3C1 (0.93) NR3C1PGRCYP3A4HIF1ACYP2C9
Dexbudesonide SCHEMBL20553136 0.84 NR3C1 (0.93) NR3C1PGRCYP3A4HIF1ACYP2C9
Budesonide SCHEMBL1130417 0.84 NR3C1 (1.00) NR3C1PGRCYP3A4HIF1ACYP2C9
Budesonide SCHEMBL21570019 0.84 NR3C1 (1.00) NR3C1PGRCYP3A4HIF1ACYP2C9
Budesonide SCHEMBL14452945 0.84 NR3C1 (1.00) NR3C1PGRCYP3A4HIF1ACYP2C9
Budesonide SCHEMBL12396756 0.84 NR3C1 (1.00) NR3C1PGRCYP3A4HIF1ACYP2C9
Budesonide SCHEMBL13695912 0.84 NR3C1 (1.00) NR3C1PGRCYP3A4HIF1ACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946146-A2 NEW AQUEOUS MEDICAMENT PREPARATIONS FOR THE PRODUCTION OF PROPELLENT GAS-FREE AEROSOLS Boehringer Ingelheim Pharma KG (DE) 1999-10-06 — — EP disclosed
WO-1998027959-A2 NEW AQUEOUS MEDICAMENT PREPARATIONS FOR THE PRODUCTION OF PROPELLENT GAS-FREE AEROSOLS BOEHRINGER INGELHEIM PHARMA KG (DE) 1998-07-02 — — WO disclosed
EP-0835098-A1 NEW, STABLE MEDICINAL COMPOSITIONS FOR GENERATING PROPELLANT-FREE AEROSOLS BOEHRINGER INGELHEIM KG (DE) 1998-04-15 — — EP disclosed
WO-1997001329-A1 NEW, STABLE MEDICINAL COMPOSITIONS FOR GENERATING PROPELLANT-FREE AEROSOLS BOEHRINGER INGELHEIM KG (DE) 1997-01-16 — — WO disclosed
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