Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.55 |
| ▸ | MAOB | P27338 | 5/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | MGAM | O43451 | 1/20 | 0.47 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.46 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.45 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.45 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4398696 | 0.95 | MAOB (0.56) | CYP2C9CYP2C19MAOBNPC1RAB9A | |
| SCHEMBL2306751 | 0.85 | MGAM (0.62) | CYP2C9MGAMALDH1A1POLBALOX15 | |
| SCHEMBL2204650 | 0.84 | MAOB (0.65) | CYP2C9CYP2C19MAOBNPC1RAB9A | |
| SCHEMBL29793278 | 0.80 | MAOB (0.56) | CYP2C9CYP2C19MAOBNPC1RAB9A | |
| SCHEMBL26680685 | 0.80 | MAOB (0.56) | CYP2C9CYP2C19MAOBNPC1RAB9A | |
| SCHEMBL29940590 | 0.80 | RXFP1 (0.53) | L3MBTL1MAPTKDM4EPOLBALOX15 | |
| SCHEMBL846386 | 0.79 | TSHR (0.61) | CYP2C9CYP2C19MAOBNPC1RAB9A | |
| SCHEMBL26798599 | 0.79 | LMNA (0.54) | CYP2C9CYP2C19MAOBNPC1RAB9A | |
| SCHEMBL2205670 | 0.79 | ALDH1A1 (0.52) | CYP2C9CYP2C19MAOBNPC1RAB9A | |
| SCHEMBL26681960 | 0.79 | MAOB (0.61) | CYP2C9CYP2C19MAOBNPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1296972-A1 | ARYLMETHYLAMINE DERIVATIVES FOR USE AS TRYPTASE INHIBITORS | Aventis Pharmaceuticals Inc. (US) | 2003-04-02 | — | — | EP | disclosed |
| WO-2001090101-A1 | ARYLMETHYLAMINE DERIVATIVES FOR USE AS TRYPTASE INHIBITORS | AVENTIS PHARMACEUTICALS INC. (US) | 2001-11-29 | — | — | WO | disclosed |