Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 7/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | TOP1 | P11387 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 2/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.36 |
| ▸ | PNLIP | P16233 | 3/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22453069 | 0.93 | RAB9A (0.47) | RAB9AALDH1A1NPSR1HTTNPC1 | |
| SCHEMBL22453756 | 0.89 | CNR2 (0.49) | RAB9AALDH1A1NPSR1HTTNPC1 | |
| SCHEMBL22453074 | 0.82 | PARP1 (0.41) | RAB9AALDH1A1HTTNPC1MEN1 | |
| SCHEMBL22453075 | 0.81 | DHODH (0.49) | RAB9AALDH1A1NPSR1HTTNPC1 | |
| SCHEMBL22453440 | 0.79 | TOP1 (0.39) | ALDH1A1MEN1KMT2AMAPTGAA | |
| SCHEMBL22453117 | 0.78 | CNR2 (0.53) | RAB9AALDH1A1NPSR1HTTNPC1 | |
| SCHEMBL22453427 | 0.77 | CNR2 (0.57) | RAB9AALDH1A1NPSR1HTTNPC1 | |
| SCHEMBL22453757 | 0.77 | MAPT (0.42) | MEN1KMT2AMAPTTOP1PNLIP | |
| SCHEMBL22453205 | 0.76 | MAPT (0.46) | MAPTPNLIP | |
| SCHEMBL22453159 | 0.75 | PDE7A (0.43) | ALDH1A1NPC1MEN1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |