Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL11301238 | 0.85 | CYP3A4 (0.37) | CYP3A4MAPK1PNMTCYP2A6NOTUM | |
| SCHEMBL30055353 | 0.85 | CYP3A4 (0.37) | CYP3A4MAPK1PNMTCYP2A6NOTUM | |
| SCHEMBL11427181 | 0.85 | PNMT (0.33) | CYP3A4MAPK1PNMT | |
| SCHEMBL8135310 | 0.83 | NOTUM (0.33) | NOTUM | |
| SCHEMBL8279449 | 0.79 | PNMT (0.43) | CYP3A4MAPK1PNMTCYP2A6NOTUM | |
| SCHEMBL859436 | 0.77 | CYP3A4 (0.36) | CYP3A4MAPK1PNMTCYP2A6 | |
| SCHEMBL8119182 | 0.75 | AKR1B1 (0.41) | CYP3A4MAPK1PNMTCYP2A6 | |
| SCHEMBL2090168 | 0.75 | CYP3A4 (0.46) | CYP3A4MAPK1PNMTCYP2A6 | |
| SCHEMBL19810393 | 0.74 | CYP3A4 (0.36) | CYP3A4MAPK1PNMTCYP2A6NOTUM | |
| SCHEMBL8126055 | 0.73 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6156940-A | Process for producing optically active carbinols | SUMIKA FINE CHEMICALS COMPANY, LIMITED (JP) | 2000-12-05 | — | — | US | disclosed |
| EP-0713848-B1 | Process for producing optically active carbinols | SUMIKA FINE CHEMICALS COMPANY (JP) | 1999-09-08 | — | — | EP | disclosed |
| US-5831132-A | REDUCING AGENT FROM BORANES AND AMINO ALCOHOLS | SUMIKA FINE CHEMICALS COMPANY, LTD. (JP) | 1998-11-03 | — | — | US | disclosed |
| EP-0713848-A1 | Process for producing optically active carbinols | SUMIKA FINE CHEMICALS Company, Limited (JP) | 1996-05-29 | — | — | EP | disclosed |