Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 7/20 | 0.33 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9845890 | 1.00 | SMN1; SMN2 (0.35) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL9845862 | 0.95 | SMN1; SMN2 (0.38) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL9845900 | 0.83 | ACHE (0.38) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL9353125 | 0.80 | EPHX1 (0.42) | EPHX1ACHETSHR | |
| SCHEMBL9480518 | 0.78 | KMT2A (0.41) | HPGDCYP2D6 | |
| SCHEMBL9845863 | 0.77 | SMN1; SMN2 (0.36) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL9845893 | 0.77 | SMN1; SMN2 (0.36) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL7616231 | 0.77 | MME (0.42) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL1608506 | 0.75 | EPHX1 (0.43) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL16054263 | 0.73 | EPHX1 (0.44) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 |
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-0414533-A1 | Use of iodopropargyl esters of alpha-amino acid derivatives as antimicrobial agents | ROHM AND HAAS COMPANY (US) | 1991-02-27 | — | — | EP | claimed |