Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 11/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.61 |
| ▸ | CASP1 | P29466 | 1/20 | 0.61 |
| ▸ | CASP7 | P55210 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.56 |
| ▸ | KDM5A | P29375 | 1/20 | 0.49 |
| ▸ | TTR | P02766 | 2/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL470697 | 0.84 | ALOX5 (0.46) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL8711628 | 0.81 | MAOA (0.64) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL12608741 | 0.81 | MAOA (0.68) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL24663168 | 0.79 | ALOX5 (0.42) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL3267918 | 0.78 | MAOA (0.64) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL5782106 | 0.78 | MAOA (0.64) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL29547534 | 0.78 | MAOA (0.64) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL3383138 | 0.78 | MAOA (0.64) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL31193433 | 0.78 | MAOA (0.64) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL1788224 | 0.78 | MAOA (1.00) | MAOAKDM4EALDH1A1GLACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1896467-B1 | TRICYCLIC OPIOID MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-01 | — | — | EP | disclosed |