Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Phenylbutazone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 known ✓ | P23219 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | LMNA | P02545 | 2/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.67 |
| ▸ | RAB9A | P51151 | 2/20 | 0.67 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 1/20 | 0.67 |
| ▸ | HPGD | P15428 | 1/20 | 0.67 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.67 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | ELANE | P08246 | 2/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Phenylbutazone SCHEMBL2475757 | 0.93 | ALDH1A1 (0.58) | ALDH1A1CYP3A4LMNAPTGS1CYP1A2 | |
| Phenylbutazone SCHEMBL11269971 | 0.90 | ALDH1A1 (0.72) | ALDH1A1CYP3A4LMNAPTGS1CYP1A2 | |
| Phenylbutazone SCHEMBL3632 | 0.88 | RAB9A (0.82) | ALDH1A1CYP3A4LMNAPTGS1CYP1A2 | |
| Phenylbutazone SCHEMBL8005041 | 0.88 | RAB9A (0.82) | ALDH1A1CYP3A4LMNAPTGS1CYP1A2 | |
| Phenylbutazone SCHEMBL2874252 | 0.87 | RAB9A (0.80) | ALDH1A1CYP3A4LMNAPTGS1CYP1A2 | |
| Phenylbutazone SCHEMBL2122724 | 0.87 | RAB9A (0.80) | ALDH1A1CYP3A4LMNAPTGS1CYP1A2 | |
| Phenylbutazone SCHEMBL7715162 | 0.87 | RAB9A (0.80) | ALDH1A1CYP3A4LMNAPTGS1CYP1A2 | |
| Phenylbutazone SCHEMBL10913190 | 0.87 | RAB9A (0.80) | ALDH1A1CYP3A4LMNAPTGS1CYP1A2 | |
| Phenylbutazone SCHEMBL21694456 | 0.87 | RAB9A (0.80) | ALDH1A1CYP3A4LMNAPTGS1CYP1A2 | |
| SCHEMBL29489697 | 0.82 | ALDH1A1 (0.73) | ALDH1A1CYP3A4LMNAPTGS1CYP1A2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040224114-A1 | Roofing system and tile | ARMACELL ENTERPRISE GMBH (DE) | 2004-11-11 | — | — | US | claimed |
| US-20030012946-A1 | Coated polymeric foam | ARMACELL ENTERPRISE GMBH (DE) | 2003-01-16 | — | — | US | claimed |
| EP-1270653-A2 | Coated polymeric foam | Armacell Enterprise GmbH (DE) | 2003-01-02 | — | — | EP | claimed |
| US-20040224114-A1 | Roofing system and tile | ARMACELL ENTERPRISE GMBH (DE) | 2004-11-11 | — | — | US | disclosed |
| US-20030012946-A1 | Coated polymeric foam | ARMACELL ENTERPRISE GMBH (DE) | 2003-01-16 | — | — | US | disclosed |
| EP-1270653-A2 | Coated polymeric foam | Armacell Enterprise GmbH (DE) | 2003-01-02 | — | — | EP | disclosed |