Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | HSD17B3 | P37058 | 6/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13714164 | 0.84 | HDAC3 (0.46) | MAPK1ALDH1A1HDAC3HDAC1LMNA | |
| SCHEMBL6656225 | 0.84 | HTT (0.51) | HTTTSHRTP53CYP3A4MAPK1 | |
| SCHEMBL6693929 | 0.82 | GABRA1 (0.42) | HTTCYP3A4ALDH1A1HDAC3HDAC1 | |
| SCHEMBL6667788 | 0.81 | HTT (0.49) | HTTTSHRTP53CYP3A4MAPK1 | |
| SCHEMBL1493255 | 0.81 | HTT (0.49) | HTTTSHRTP53CYP3A4MAPK1 | |
| SCHEMBL27820649 | 0.80 | LIPG (0.53) | HTTALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL822011 | 0.80 | NR4A2 (0.47) | HTTTSHRCYP3A4ALDH1A1HDAC3 | |
| SCHEMBL28515835 | 0.80 | HTT (0.50) | HTTTSHRALDH1A1LMNAMEN1 | |
| SCHEMBL3859568 | 0.79 | TSHR (0.69) | TSHRTP53CYP3A4MAPK1ALDH1A1 | |
| SCHEMBL28105478 | 0.78 | ALDH1A1 (0.49) | HTTTSHRTP53CYP3A4MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4064132-A | ANTIINFLAMMATORY AGENTS | JANSSEN PHARMACEUTICA N.V. (BE) | 1977-12-20 | — | — | US | disclosed |
| US-4060528-A | ANTIINFLAMMATORY | JANSSEN PHARMACEUTICA N.V. (BE) | 1977-11-29 | — | — | US | disclosed |
| US-4035376-A | ESTERS, AMIDES, HYDROXAMIC ACIDS, ANTIINFLAMMATORY | JANSSEN PHARMACEUTICA N.V. (BE) | 1977-07-12 | — | — | US | disclosed |