Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 7/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | TDO2 | P48775 | 1/20 | 0.30 |
| ▸ | TRPV3 | Q8NET8 | 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 | |
|---|---|---|---|---|
| SCHEMBL22872108 | 0.86 | PDE3B (0.31) | — | |
| SCHEMBL29940748 | 0.80 | QPCT (0.40) | CYP2C9OPRL1OPRM1OPRK1ALDH1A1 | |
| SCHEMBL23291419 | 0.80 | QPCT (0.40) | CYP2C9OPRL1OPRM1OPRK1ALDH1A1 | |
| SCHEMBL15255890 | 0.78 | KDM4E (0.37) | CYP2C9OPRL1ALDH1A1LMNAMAPT | |
| SCHEMBL27878839 | 0.78 | KDM4E (0.37) | CYP2C9OPRL1ALDH1A1LMNAMAPT | |
| SCHEMBL23346032 | 0.77 | CYP2C9 (0.47) | CYP2C9OPRL1OPRM1OPRK1ALDH1A1 | |
| SCHEMBL15834706 | 0.77 | OPRL1 (0.40) | CYP2C9OPRL1ALDH1A1LMNAMAPT | |
| SCHEMBL21609926 | 0.77 | OPRL1 (0.40) | CYP2C9OPRL1ALDH1A1LMNAMAPT | |
| SCHEMBL17356587 | 0.76 | GRM2 (0.35) | CYP2C9OPRL1OPRM1OPRK1ALDH1A1 | |
| SCHEMBL17108451 | 0.76 | CYP2C9 (0.39) | CYP2C9OPRL1ALDH1A1LMNAMAPT |
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-20210139779-A1 | Thiophene compound, liquid-crystalline medium and liquid-crystal display comprising the same | MERCK PATENT GMBH (DE) | 2021-05-13 | — | — | US | disclosed |