Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.59 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.58 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.58 |
| ▸ | CYP4Z1 | Q86W10 | 3/20 | 0.58 |
| ▸ | CYP4F11 | Q9HBI6 | 1/20 | 0.58 |
| ▸ | CYP4F12 | Q9HCS2 | 1/20 | 0.58 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
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 SCHEMBL11489404 | 0.98 | CYP1A2 (0.58) | CYP1A2CYP4F2CYP4A11CYP4Z1CYP4F11 | |
| SCHEMBL9331606 | 0.95 | CYP4Z1 (0.59) | CYP1A2CYP4F2CYP4A11CYP4Z1CYP4F11 | |
| Hydrochloric Acid SCHEMBL9265306 | 0.94 | CYP4Z1 (0.58) | CYP1A2CYP4F2CYP4A11CYP4Z1CYP4F11 | |
| SCHEMBL10463270 | 0.93 | CYP1A2 (0.65) | CYP1A2CYP4F2CYP4A11CYP4Z1CYP4F11 | |
| Hydrochloric Acid SCHEMBL11473826 | 0.92 | CYP4Z1 (0.56) | CYP1A2CYP4F2CYP4A11CYP4Z1CYP4F11 | |
| Hydrochloric Acid SCHEMBL11481637 | 0.92 | CYP4Z1 (0.56) | CYP1A2CYP4F2CYP4A11CYP4Z1CYP4F11 | |
| Hydrochloric Acid SCHEMBL11472241 | 0.92 | CYP4Z1 (0.56) | CYP1A2CYP4F2CYP4A11CYP4Z1CYP4F11 | |
| SCHEMBL1467579 | 0.90 | CYP4F2 (0.58) | CYP1A2CYP4F2CYP4A11CYP4Z1CYP4F11 | |
| SCHEMBL8819359 | 0.90 | CYP4F2 (0.72) | CYP1A2CYP4F2CYP4A11CYP4Z1CYP4F11 | |
| Hydrochloric Acid SCHEMBL11479609 | 0.89 | CYP4Z1 (0.57) | CYP1A2CYP4F2CYP4A11CYP4Z1CYP4F11 |
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 |
|---|---|---|---|---|---|---|---|
| US-4948809-A | TREATMENT OF AILMENTS DUE TO THROMBOCYTE AGGREGATION OR KIDNEY DYSFUNCTION | BOEHRINGER MANNHEIM GMBH (DE) | 1990-08-14 | — | — | US | disclosed |