Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13816898 | 0.86 | NPC1 (0.47) | LMNATSHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4292756 | 0.85 | NPC1 (0.44) | LMNATSHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5267787 | 0.84 | NPC1 (0.44) | LMNATSHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5271516 | 0.83 | SMYD3 (0.55) | LMNATSHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4289279 | 0.82 | ALDH1A1 (0.43) | LMNATSHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5271386 | 0.82 | ALDH1A1 (0.46) | LMNATSHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5266576 | 0.82 | LMNA (0.48) | LMNATSHRNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5269911 | 0.82 | KMT2A (0.47) | TSHRNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL5269272 | 0.82 | KDM4E (0.55) | NPC1RAB9ASMN1; SMN2ALDH1A1PKM | |
| SCHEMBL5271084 | 0.81 | LMNA (0.53) | LMNASMN1; SMN2ALDH1A1L3MBTL1MEN1 |
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-1847531-A1 | PYRAZOLE COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2007-10-24 | — | — | EP | disclosed |