Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 10/20 | 0.47 |
| ▸ | NPC1 | O15118 | 9/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | DEGS1 | O15121 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL22755205 | 0.89 | NPC1 (0.46) | RAB9ANPC1TP53MITFGAA | |
| SCHEMBL22755274 | 0.82 | GAA (0.53) | RAB9ANPC1GAADEGS1POLB | |
| SCHEMBL22755081 | 0.76 | ATM (0.43) | RAB9ANPC1KMT2AMEN1POLB | |
| SCHEMBL22755242 | 0.74 | KMT2A (0.57) | RAB9ANPC1TP53GAAKMT2A | |
| SCHEMBL22755207 | 0.73 | HPGD (0.51) | TP53KMT2AMEN1TDP1GRM5 | |
| SCHEMBL22755172 | 0.72 | GPR55 (0.56) | RAB9ANPC1GAAKMT2AMEN1 | |
| SCHEMBL4074720 | 0.70 | DEGS1 (0.55) | RAB9ANPC1TP53MITFGAA | |
| SCHEMBL22729744 | 0.69 | RAB9A (0.48) | RAB9ANPC1TP53MITFGAA | |
| SCHEMBL25142835 | 0.69 | NPC1 (0.60) | RAB9ANPC1TP53MITFGAA | |
| SCHEMBL31665366 | 0.69 | NPC1 (0.60) | RAB9ANPC1TP53MITFGAA |
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 |