Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | CNKSR1 | Q969H4 | 4/20 | 0.46 |
| ▸ | AKT1 | P31749 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | PLK1 | P53350 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CCR2 | P41597 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL1653185 | 0.78 | ALDH1A1 (0.44) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL1653068 | 0.76 | MEN1 (0.46) | ALDH1A1CNKSR1AKT1MEN1KMT2A | |
| SCHEMBL5046916 | 0.73 | MAPT (0.47) | ALDH1A1TSHRCNKSR1AKT1MEN1 | |
| SCHEMBL7570349 | 0.70 | ALDH1A1 (0.60) | ALDH1A1CNKSR1AKT1MEN1KMT2A | |
| SCHEMBL2354908 | 0.70 | MEN1 (0.53) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL1654094 | 0.70 | ALDH1A1 (0.50) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL1652707 | 0.69 | CNKSR1 (0.47) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL12783356 | 0.69 | MEN1 (0.49) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL7571210 | 0.68 | CCR2 (0.67) | ALDH1A1MEN1KMT2AMAPTTP53 | |
| SCHEMBL1653233 | 0.68 | MEN1 (0.45) | ALDH1A1CYP3A4CYP2C9TSHRCYP2C19 |
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-1873144-A1 | FUSED HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2008-01-02 | — | — | EP | disclosed |