Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.38 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.38 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.38 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.38 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.38 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9848113 | 0.80 | PTGS2 (0.43) | MERTKPTGS1PTGS2HTR6 | |
| SCHEMBL9848173 | 0.79 | POLB (0.37) | L3MBTL1SMN1; SMN2POLBMERTKHTR6 | |
| Hydrochloric Acid SCHEMBL9848205 | 0.76 | KMT2A (0.47) | LMNAL3MBTL1KMT2AKDM4EHTT | |
| SCHEMBL9848139 | 0.75 | KMT2A (0.49) | LMNAL3MBTL1CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL9848204 | 0.72 | KMT2A (0.64) | LMNAKMT2AHTTSMN1; SMN2POLB | |
| Hydrochloric Acid SCHEMBL9848111 | 0.71 | POLB (0.41) | LMNAKMT2APOLBTSHR | |
| Hydrochloric Acid SCHEMBL9848200 | 0.71 | POLB (0.46) | KMT2APOLB | |
| SCHEMBL9848182 | 0.70 | POLB (0.39) | HTTSMN1; SMN2POLBMERTKHTR6 | |
| Hydrochloric Acid SCHEMBL9848157 | 0.69 | POLB (0.38) | KMT2APOLBMERTKHTR6 | |
| Hydrochloric Acid SCHEMBL9848207 | 0.68 | HRH3 (0.32) | S1PR1CYP1A2CYP2C9KMT2ASMN1; SMN2 |
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-0414391-A2 | Aminoketone derivatives and use thereof | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1991-02-27 | — | — | EP | disclosed |