Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 2/20 | 0.42 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PLG | P00747 | 1/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 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 | |
|---|---|---|---|---|
| SCHEMBL1855383 | 0.81 | FFAR1 (0.42) | MAOBMAOAMMP2NPC1RAB9A | |
| SCHEMBL6023242 | 0.80 | MAOB (0.46) | MAOBMAOALTA4HNR5A1PDK2 | |
| SCHEMBL1853979 | 0.79 | KDM4E (0.49) | MAOBLTA4HCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL1856177 | 0.73 | SLC2A1 (0.40) | THRATHRBCYP2C9 | |
| SCHEMBL5133737 | 0.73 | TP53 (0.43) | MAOBMAOATHRATHRBCYP1A2 | |
| SCHEMBL1857139 | 0.72 | MEN1 (0.44) | MAOBMAOANPC1THRATHRB | |
| SCHEMBL5049002 | 0.71 | LTA4H (0.43) | MAOBLTA4HNR5A1PDK2NPC1 | |
| SCHEMBL27666007 | 0.69 | IDO1 (0.53) | MAOBMAOA | |
| SCHEMBL29919692 | 0.68 | S1PR1 (0.50) | THRATHRBCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10778567 | 0.68 | S1PR1 (0.50) | THRATHRBCYP1A2CYP3A4CYP2C9 |
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-1470102-B1 | SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) | MERCK SERONO SA (CH) | 2011-05-25 | — | — | EP | disclosed |