Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | CHAT | P28329 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | FBP1 | P09467 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL11157130 | 0.85 | HTR1B (0.49) | NFE2L2TRPA1CYP1A2RELACYP1A1 | |
| SCHEMBL11157128 | 0.85 | HTR1B (0.49) | NFE2L2TRPA1CYP1A2RELACYP1A1 | |
| SCHEMBL9483663 | 0.85 | NFE2L2 (0.61) | NFE2L2TRPA1CYP1A2CYP1A1CYP19A1 | |
| SCHEMBL9483671 | 0.85 | NFE2L2 (0.61) | NFE2L2TRPA1CYP1A2CYP1A1CYP19A1 | |
| SCHEMBL8708519 | 0.82 | CCNB2 (0.55) | NFE2L2CYP1A2CYP2C9CYP2C19HPGD | |
| SCHEMBL8708521 | 0.82 | CCNB2 (0.55) | NFE2L2CYP1A2CYP2C9CYP2C19HPGD | |
| SCHEMBL11156861 | 0.81 | MEN1 (0.55) | NFE2L2CYP1A2CYP2C19ALDH1A1KMT2A | |
| SCHEMBL11156862 | 0.81 | MEN1 (0.55) | NFE2L2CYP1A2CYP2C19ALDH1A1KMT2A | |
| SCHEMBL11159582 | 0.80 | KMT2A (0.50) | CYP1A2LMNACYP2C19ALDH1A1KMT2A | |
| SCHEMBL11159560 | 0.80 | KMT2A (0.50) | CYP1A2LMNACYP2C19ALDH1A1KMT2A |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5192786-A | Fungicides, anticonvulsants, antisecretory | ORTHO PHARMACEUTICAL CORPORATION (US) | 1993-03-09 | — | — | US | disclosed |