Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 12/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.44 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19908562 | 0.82 | ALDH1A1 (0.53) | HPGDALDH1A1TSHRRECQLCYP2C9 | |
| SCHEMBL4287374 | 0.81 | KDM4E (0.45) | ALDH1A1POLB | |
| SCHEMBL30480874 | 0.81 | KDM4E (0.45) | ALDH1A1POLB | |
| SCHEMBL24316518 | 0.81 | MAPT (0.40) | HPGDALDH1A1NPC1RAB9AGFER | |
| SCHEMBL30480856 | 0.81 | MAPT (0.40) | HPGDALDH1A1NPC1RAB9AGFER | |
| SCHEMBL17346260 | 0.80 | HPGD (0.59) | HPGDALDH1A1TSHRRECQLCYP1A2 | |
| SCHEMBL30480851 | 0.78 | OTUD7B (0.39) | HPGDTSHRSMN1; SMN2RAB9AKMT2A | |
| SCHEMBL30480840 | 0.75 | RARA (0.50) | ALDH1A1CYP2C9CYP2C19NPC1RAB9A | |
| SCHEMBL24316517 | 0.75 | RARA (0.50) | ALDH1A1CYP2C9CYP2C19NPC1RAB9A | |
| SCHEMBL22895588 | 0.74 | CRBN (0.58) | HPGDALDH1A1TSHRRECQLCYP1A2 |
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-3287441-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-02-28 | — | — | EP | disclosed |