Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.35 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2486026 | 0.89 | MAPK1 (0.43) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL2485768 | 0.86 | BCHE (0.42) | NPC1RAB9ALTB4R2KMT2AALDH1A1 | |
| SCHEMBL416316 | 0.79 | MTOR (0.44) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL416480 | 0.79 | BCHE (0.48) | RAB9AMEN1KMT2AALDH1A1HTT | |
| SCHEMBL412372 | 0.78 | ALDH1A1 (0.53) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL416332 | 0.78 | BCHE (0.49) | NPC1RAB9ALTB4R2MEN1KMT2A | |
| SCHEMBL417570 | 0.77 | ACHE (0.50) | MEN1KMT2ATDP1GAABCHE | |
| SCHEMBL412947 | 0.76 | FOLH1 (0.47) | NPC1RAB9ALTB4R2KMT2AALDH1A1 | |
| SCHEMBL417283 | 0.75 | NPC1 (0.43) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL416207 | 0.73 | MAPK1 (0.60) | NPC1RAB9AKMT2AALDH1A1SMN1; SMN2 |
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-2376431-A1 | NOVEL SUBSTITUTED ARYL DERIVATIVES, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES AS ANTI-HIV AGENTS | LABORATOIRE BIODIM (FR) | 2011-10-19 | — | — | EP | disclosed |
| WO-2010066847-A1 | NOVEL SUBSTITUTED ARYL DERIVATIVES, THEIR PROCESS OF PREPARATION AND THEIR THERAPEUTICAL USES AS ANTI-HIV AGENTS | CELLVIR (FR) | 2010-06-17 | — | — | WO | disclosed |