Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
| ▸ | EGFR | P00533 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.52 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.51 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL2087168 | 0.90 | HPGD (0.61) | MAPTALDH1A1KDM4EGAACASP1 | |
| SCHEMBL4262445 | 0.88 | ALDH1A1 (0.55) | MAPTALDH1A1KDM4EGAACASP1 | |
| SCHEMBL7696486 | 0.86 | ALDH1A1 (0.54) | MAPTALDH1A1KDM4EGAACASP1 | |
| SCHEMBL8181367 | 0.86 | SIRT2 (0.47) | MAPTALDH1A1KDM4EGAACASP1 | |
| SCHEMBL4445669 | 0.86 | KDM4E (0.53) | MAPTALDH1A1KDM4EGAACASP1 | |
| SCHEMBL8178846 | 0.85 | ALDH1A1 (0.47) | MAPTALDH1A1KDM4EGAACASP1 | |
| SCHEMBL8174978 | 0.84 | ALDH1A1 (0.46) | MAPTALDH1A1KDM4EGAACASP1 | |
| SCHEMBL7692306 | 0.83 | KDM4E (0.56) | MAPTALDH1A1KDM4EGAACASP1 | |
| Carbazole SCHEMBL30528371 | 0.83 | KDM4E (0.56) | MAPTALDH1A1KDM4EGAACASP1 | |
| SCHEMBL8181871 | 0.82 | ALDH1A1 (0.44) | MAPTALDH1A1KDM4EGAACASP1 |
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-2002020478-A1 | N-BENZYLINDOLE-3-ACETIC ACID DERIVATIVES FOR USE IN THE TREATMENT OF DRUG RESISTAN CANCER | DUBLIN CITY UNIVERSITY (IE) | 2002-03-14 | — | — | WO | disclosed |