Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6526808 | 0.80 | CYP1A2 (0.35) | CYP1A2CYP2C19ALDH1A1NPC1PLA2G1B | |
| SCHEMBL28556575 | 0.78 | ALDH1A1 (0.40) | CYP1A2CYP2C19ALDH1A1NPC1PLA2G1B | |
| SCHEMBL6470599 | 0.75 | ALDH1A1 (0.38) | CYP1A2CYP2C19ALDH1A1NPC1PLA2G1B | |
| SCHEMBL6472439 | 0.71 | ALDH1A1 (0.35) | CYP1A2CYP2C19ALDH1A1NPC1PLA2G1B | |
| SCHEMBL540391 | 0.70 | ALDH1A1 (0.47) | CYP1A2CYP2C19ALDH1A1NPC1PLA2G1B | |
| SCHEMBL6526472 | 0.69 | ALDH1A1 (0.33) | CYP1A2CYP2C19ALDH1A1NPC1PLA2G1B | |
| SCHEMBL18261205 | 0.68 | ALDH1A1 (0.44) | CYP1A2CYP2C19ALDH1A1NPC1PLA2G1B | |
| SCHEMBL945915 | 0.68 | ALDH1A1 (0.44) | CYP1A2CYP2C19ALDH1A1NPC1PLA2G1B | |
| Hydrochloric Acid SCHEMBL4914354 | 0.68 | ALDH1A1 (0.33) | CYP1A2CYP2C19ALDH1A1NPC1PLA2G1B | |
| Hydrochloric Acid SCHEMBL7709395 | 0.68 | ALDH1A1 (0.33) | CYP1A2CYP2C19ALDH1A1NPC1PLA2G1B |
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-1224228-A1 | POLYOLEFIN PRODUCTION | ATOFINA Research (BE) | 2002-07-24 | — | — | EP | disclosed |
| WO-2001019877-A1 | POLYOLEFIN PRODUCTION | ATOFINA RESEARCH (BE) | 2001-03-22 | — | — | WO | disclosed |