Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6809108 | 0.80 | CYP1A2 (0.50) | CYP1A2CYP3A4CYP2C19CYP2C9L3MBTL1 | |
| SCHEMBL13990839 | 0.79 | CYP1A2 (0.49) | CYP1A2CYP3A4CYP2C19CYP2C9L3MBTL1 | |
| SCHEMBL7524895 | 0.77 | CYP1A2 (0.45) | CYP1A2CYP3A4CYP2C19CYP2C9L3MBTL1 | |
| SCHEMBL13990721 | 0.77 | CYP1A2 (0.45) | CYP1A2CYP3A4CYP2C19CYP2C9L3MBTL1 | |
| SCHEMBL16297352 | 0.76 | TP53 (0.46) | CYP1A2CYP3A4CYP2C19CYP2C9L3MBTL1 | |
| SCHEMBL7524889 | 0.76 | CYP1A2 (0.44) | CYP1A2CYP3A4CYP2C19CYP2C9L3MBTL1 | |
| SCHEMBL10715332 | 0.76 | L3MBTL1 (0.51) | CYP1A2CYP3A4CYP2C19CYP2C9L3MBTL1 | |
| SCHEMBL7092726 | 0.76 | HSD11B1 (0.45) | L3MBTL1ALDH1A1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL5226592 | 0.75 | ALDH1A1 (0.61) | CYP1A2CYP3A4CYP2C19CYP2C9L3MBTL1 | |
| SCHEMBL8600916 | 0.74 | MEN1 (0.61) | CYP1A2CYP3A4CYP2C19CYP2C9L3MBTL1 |
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-6723743-B1 | TREATING PATIENT SUFFERING FROM RHEUMATOID ARTHRITIS, PSORIASIS, BRONCHIAL ASTHMA, ALZHEIMER'S DISEASE, MYOCARDIAL INFARCTION OR ATHEROSCLEROSIS | NEUROGEN CORPORATION | 2004-04-20 | — | — | US | claimed |