Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9393815 | 1.00 | ALDH1A1 (0.47) | ALDH1A1ATMNAAATSHRHPGD | |
| SCHEMBL28009595 | 0.85 | ALDH1A1 (0.44) | ALDH1A1ATMNAAATSHRHPGD | |
| SCHEMBL2761758 | 0.85 | ALDH1A1 (0.44) | ALDH1A1ATMNAAATSHRHPGD | |
| SCHEMBL624749 | 0.84 | ALDH1A1 (0.54) | ALDH1A1ATMNAAATSHRHPGD | |
| SCHEMBL7181783 | 0.84 | ALDH1A1 (0.54) | ALDH1A1ATMNAAATSHRHPGD | |
| SCHEMBL213810 | 0.84 | ALDH1A1 (0.54) | ALDH1A1ATMNAAATSHRHPGD | |
| Hydrochloric Acid SCHEMBL213809 | 0.82 | ALDH1A1 (0.52) | ALDH1A1ATMNAAATSHRHPGD | |
| Hydrochloric Acid SCHEMBL4380145 | 0.82 | ALDH1A1 (0.52) | ALDH1A1ATMNAAATSHRHPGD | |
| Hydrochloric Acid SCHEMBL4731637 | 0.82 | ALDH1A1 (0.52) | ALDH1A1ATMNAAATSHRHPGD | |
| SCHEMBL7373318 | 0.81 | ALDH1A1 (0.44) | ALDH1A1ATMNAAATSHRHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1204654-A1 | BENZOFURYLPIPERAZINES AND BENZOFURYLHOMOPIPERAZINES: SEROTONIN AGONISTS | ELI LILLY AND COMPANY (US) | 2002-05-15 | — | — | EP | disclosed |
| WO-2001009111-A1 | BENZOFURYLPIPERAZINES AND BENZOFURYLHOMOPIPERAZINES: SEROTONIN AGONISTS | ELI LILLY AND COMPANY (US) | 2001-02-08 | — | — | WO | disclosed |