Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | STAT1 | P42224 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | AKT1 | P31749 | 1/20 | 0.46 |
| ▸ | IRS1 | P35568 | 1/20 | 0.46 |
| ▸ | GAB1 | Q13480 | 1/20 | 0.46 |
| ▸ | CDK1 | P06493 | 2/20 | 0.46 |
| ▸ | CDK4 | P11802 | 2/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12852499 | 0.83 | AKT1 (0.51) | ALDH1A1SMN1; SMN2HPGDTSHRRECQL | |
| SCHEMBL20888432 | 0.82 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2HPGDTSHRNPC1 | |
| SCHEMBL2444824 | 0.79 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2HPGDTSHRNPC1 | |
| SCHEMBL2444829 | 0.79 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2HPGDTSHRMEN1 | |
| SCHEMBL25386799 | 0.79 | SMN1; SMN2 (0.62) | ALDH1A1SMN1; SMN2HPGDTSHRMEN1 | |
| SCHEMBL282840 | 0.78 | AKT1 (0.67) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL6887350 | 0.77 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2HPGDTSHRMEN1 | |
| SCHEMBL299130 | 0.75 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2HPGDTSHRKMT2A | |
| SCHEMBL4315953 | 0.75 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2HPGDTSHRMEN1 | |
| SCHEMBL22134467 | 0.75 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2HPGDTSHRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011081173-A1 | TETRACYCLIC COMPOUND | 協和発酵キリン株式会社 (JP) | 2011-07-07 | — | — | WO | disclosed |