Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HEXA | P06865 | 3/20 | 0.47 |
| ▸ | HEXB | P07686 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22181868 | 0.81 | HEXA (0.67) | HEXAHEXBDRD2DRD3KDM4E | |
| SCHEMBL22181932 | 0.80 | MEN1 (0.43) | HEXAHEXBMEN1KMT2APOLB | |
| SCHEMBL22181927 | 0.73 | MEN1 (0.38) | HEXAHEXBMEN1KMT2APOLB | |
| SCHEMBL22182063 | 0.72 | DNMT1 (0.38) | MEN1KMT2APOLBCASP1ALDH1A1 | |
| SCHEMBL22182103 | 0.72 | DNMT1 (0.40) | MEN1KMT2APOLBCASP1ALDH1A1 | |
| SCHEMBL22181900 | 0.71 | MEN1 (0.39) | HEXAHEXBMEN1KMT2APOLB | |
| SCHEMBL22182009 | 0.70 | MEN1 (0.34) | MEN1KMT2APOLBCASP1ALDH1A1 | |
| SCHEMBL22181897 | 0.69 | MEN1 (0.33) | MEN1KMT2APOLBCASP1ALDH1A1 | |
| SCHEMBL22182124 | 0.68 | HEXA (0.53) | HEXAHEXBMEN1KMT2ADRD2 | |
| SCHEMBL22181909 | 0.65 | SIRT1 (0.57) | HEXAHEXBMEN1KMT2APOLB |
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-2020139291-A1 | NAPHTHALIMIDE DERIVATIVES AS ANTI-PARASITIC AGENTS FOR THE TREATMENT OF LEISHMANIASIS AS WELL AS VIRAL, BACTERIAL AND NEOPLASTIC DISEASES | ISTANBUL MEDIPOL UNIVERSITESI (TR) | 2020-07-02 | — | — | WO | disclosed |