Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.41 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.41 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.41 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.41 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.41 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
| ▸ | CYP4F8 | P98187 | 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 | |
|---|---|---|---|---|
| SCHEMBL6047605 | 0.91 | CYP1A1 (0.44) | MAOBCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6047600 | 0.90 | ACHE (0.39) | MAOBCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6047619 | 0.86 | CYP1A1 (0.40) | MAOBCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL4804654 | 0.82 | ACHE (0.39) | MAOBACHEALDH1A1TDP1RAB9A | |
| SCHEMBL6047648 | 0.81 | NAAA (0.42) | CYP1A2CYP3A4CYP2D6CYP2C19CYP1A1 | |
| SCHEMBL6047633 | 0.80 | PTPN1 (0.36) | MAOBCYP1A2CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL6047602 | 0.77 | NAAA (0.37) | CYP1A2CYP3A4CYP2D6CYP2C19CYP1A1 | |
| SCHEMBL6047613 | 0.77 | THRA (0.39) | MAOBCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL5887546 | 0.77 | DYRK1A (0.44) | MAOBCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6047612 | 0.76 | MAOB (0.40) | MAOBCYP1A2CYP3A4CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2006501194-A | — | — | 2006-01-12 | — | — | JP | claimed |
| EP-1525190-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-04-27 | — | — | EP | claimed |
| WO-2004007463-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2004-01-22 | — | — | WO | claimed |