Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | TMPRSS2 | O15393 | 2/20 | 0.40 |
| ▸ | PRMT1 | Q99873 | 3/20 | 0.39 |
| ▸ | F2 | P00734 | 2/20 | 0.39 |
| ▸ | ST14 | Q9Y5Y6 | 2/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.39 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | PTP4A3 | O75365 | 1/20 | 0.39 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | S100B | P04271 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL21746252 | 0.79 | PRSS1 (0.48) | PRSS1ALDH1A1MAPTCYP3A4SMN1; SMN2 | |
| SCHEMBL21746633 | 0.75 | NR1I2 (0.44) | NR1I2GAAALDH1A1RECQLCYP2D6 | |
| SCHEMBL21746596 | 0.74 | ELANE (0.47) | GAAALDH1A1RECQLMAPTCHRM2 | |
| SCHEMBL14669419 | 0.74 | NR1I2 (0.58) | NR1I2GAAPRSS1ALDH1A1RECQL | |
| SCHEMBL21746627 | 0.74 | NR1I2 (0.46) | NR1I2GAAPRSS1ALDH1A1RECQL | |
| SCHEMBL21746470 | 0.73 | ESR1 (0.40) | NR1I2GAAALDH1A1MAPTCHRM2 | |
| SCHEMBL409427 | 0.70 | NR1I2 (0.53) | NR1I2GAAPRSS1ALDH1A1RECQL | |
| SCHEMBL48239 | 0.70 | ALDH1A1 (0.75) | NR1I2GAAPRSS1ALDH1A1RECQL | |
| SCHEMBL28106819 | 0.70 | ALDH1A1 (0.75) | NR1I2GAAPRSS1ALDH1A1RECQL | |
| SCHEMBL4751615 | 0.69 | PLK1 (0.75) | NR1I2GAAMAPTSMN1; SMN2PLK1 |
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-2944637-B1 | NITROGEN-CONTAINING HETEROCYLIC COMPOUND OR SALT THEREOF | FUJIFILM CORP (JP) | 2020-02-19 | — | — | EP | disclosed |