Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.61 |
| ▸ | RAB9A | P51151 | 8/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | MGAM | O43451 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 4/20 | 0.46 |
| ▸ | SI | P14410 | 4/20 | 0.46 |
| ▸ | MGAM2 | Q2M2H8 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9284642 | 1.00 | NPC1 (0.61) | NPC1RAB9AMEN1KMT2AMGAM | |
| SCHEMBL8943288 | 0.89 | NPC1 (0.52) | NPC1RAB9AMEN1KMT2AMGAM | |
| SCHEMBL9337494 | 0.89 | MAPT (0.44) | NPC1RAB9AMEN1KMT2AMGAM | |
| SCHEMBL3421079 | 0.87 | GAA (0.55) | NPC1RAB9AMEN1KMT2AMGAM | |
| SCHEMBL9284657 | 0.84 | MAPT (0.48) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL9429911 | 0.84 | ALDH1A1 (0.44) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL10452305 | 0.82 | MMP2 (0.41) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL261038 | 0.82 | CA12 (0.53) | NPC1RAB9AMEN1KMT2AMGAM | |
| Phenol SCHEMBL7769420 | 0.81 | MGAM (0.50) | NPC1RAB9AMGAMGAASI | |
| SCHEMBL9879580 | 0.79 | FFAR1 (0.48) | NPC1RAB9AMAPTKDM4EALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4029975-A | — | — | None | — | — | JP | disclosed |
| JP-3206081-A | — | — | None | — | — | JP | disclosed |
| JP-H0429975-A | NOVEL ESTER COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME | NIKKO KYODO CO LTD | 1992-01-31 | — | — | JP | disclosed |
| JP-H03206081-A | NEW ETHER COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING SAME COMPOUND | NIPPON MINING CO LTD | 1991-09-09 | — | — | JP | disclosed |