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Triamcinolone

Triamcinolone

SCHEMBL9837854

C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3C[C@@H](O)[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F.C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)CO

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C1

The experimentally established mechanism targets of Triamcinolone. 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 0.66
▸ HIF1A Q16665 7/20 0.66
▸ CYP3A4 P08684 6/20 0.66
▸ HSD17B10 Q99714 5/20 0.66
▸ LMNA P02545 4/20 0.66
▸ NFKB1 P19838 4/20 0.66
▸ CYP2C9 P11712 3/20 0.66
▸ PGR P06401 3/20 0.66
▸ BLM P54132 2/20 0.66
▸ PMP22 Q01453 2/20 0.66
▸ CYP2J2 P51589 1/20 0.66
▸ CYP2C19 P33261 1/20 0.66
▸ NR3C2 P08235 4/20 0.62
▸ TSHR P16473 3/20 0.62
▸ SMN1; SMN2 Q16637 3/20 0.62
▸ SHBG P04278 2/20 0.62
▸ SERPINA6 P08185 2/20 0.62
▸ MAPT P10636 1/20 0.62
▸ SLC22A2 O15244 1/20 0.62
▸ SLC22A1 O15245 1/20 0.62

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
Triamcinolone SCHEMBL593313 0.88 HIF1A (0.68) HIF1ACYP3A4NR3C1HSD17B10LMNA
Dexamethasone SCHEMBL5970721 0.86 NR3C1 (0.68) HIF1ACYP3A4NR3C1HSD17B10LMNA
Triamcinolone SCHEMBL9396948 0.86 NR3C1 (0.71) HIF1ACYP3A4NR3C1HSD17B10LMNA
Dexamethasone SCHEMBL322760 0.83 HIF1A (0.69) HIF1ACYP3A4NR3C1HSD17B10LMNA
Tixocortol Pivalate SCHEMBL4455114 0.82 HIF1A (0.60) HIF1ACYP3A4NR3C1HSD17B10LMNA
Triamcinolone SCHEMBL24622562 0.81 NR3C1 (1.00) HIF1ACYP3A4NR3C1HSD17B10LMNA
Triamcinolone SCHEMBL4759998 0.81 NR3C1 (1.00) HIF1ACYP3A4NR3C1HSD17B10LMNA
Triamcinolone SCHEMBL601462 0.81 NR3C1 (1.00) HIF1ACYP3A4NR3C1HSD17B10LMNA
Triamcinolone SCHEMBL22962813 0.81 NR3C1 (1.00) HIF1ACYP3A4NR3C1HSD17B10LMNA
Triamcinolone SCHEMBL1884154 0.81 NR3C1 (1.00) HIF1ACYP3A4NR3C1HSD17B10LMNA

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-0454773-A1 NOVEL PRODRUG DERIVATIVES OF BIOLOGICALLY ACTIVE AGENTS CONTAINING HYDROXYL GROUPS OR NH-ACIDIC GROUPS Bundgaard, Hans (DK) 1991-11-06 — — EP disclosed
WO-1990008128-A1 NOVEL PRODRUG DERIVATIVES OF BIOLOGICALLY ACTIVE AGENTS CONTAINING HYDROXYL GROUPS OR NH-ACIDIC GROUPS BUNDGAARD HANS (DK) 1990-07-26 — — WO disclosed
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