Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.46 |
| ▸ | RAB9A | P51151 | 6/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | GCK | P35557 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22755230 | 0.89 | RAB9A (0.47) | NPC1RAB9AKMT2AMEN1GRM5 | |
| SCHEMBL22755274 | 0.79 | GAA (0.53) | NPC1RAB9AGAA | |
| SCHEMBL22755207 | 0.78 | HPGD (0.51) | KMT2AMEN1GRM5TP53HTT | |
| SCHEMBL22755172 | 0.76 | GPR55 (0.56) | NPC1RAB9AKMT2AMEN1CASP3 | |
| SCHEMBL22755239 | 0.73 | MEN1 (0.50) | NPC1RAB9AKMT2AMEN1MAPK1 | |
| SCHEMBL22755081 | 0.73 | ATM (0.43) | NPC1RAB9AKMT2AMEN1KDR | |
| SCHEMBL22729669 | 0.72 | NPC1 (0.44) | NPC1RAB9AKMT2AMEN1CASP3 | |
| SCHEMBL22755242 | 0.72 | KMT2A (0.57) | NPC1RAB9AKMT2AMEN1TP53 | |
| SCHEMBL22754978 | 0.70 | LMNA (0.46) | RAB9AKMT2AMEN1HTTMAPK1 | |
| SCHEMBL22754848 | 0.70 | KDM4E (0.55) | RAB9AKMT2AMEN1HTTKDM4E |
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-3747885-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2020-12-09 | — | — | EP | disclosed |