Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | VDR | P11473 | 1/20 | 0.38 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17824144 | 1.00 | CYP2D6 (0.49) | CYP2D6ALDH1A1CYP3A4TSHRCYP2C9 | |
| SCHEMBL17823617 | 1.00 | CYP2D6 (0.49) | CYP2D6ALDH1A1CYP3A4TSHRCYP2C9 | |
| SCHEMBL15757164 | 0.85 | MAPK1 (0.48) | CYP2D6ALDH1A1CYP3A4TSHRCYP2C9 | |
| SCHEMBL14167900 | 0.85 | PRMT5 (0.47) | CYP2D6ALDH1A1CYP3A4TSHRCYP2C9 | |
| SCHEMBL4953038 | 0.83 | CYP2D6 (0.47) | CYP2D6ALDH1A1CYP3A4TSHRCYP2C9 | |
| SCHEMBL4921609 | 0.83 | CYP2D6 (0.47) | CYP2D6ALDH1A1CYP3A4TSHRCYP2C9 | |
| SCHEMBL11163644 | 0.83 | CYP2D6 (0.47) | CYP2D6ALDH1A1CYP3A4TSHRCYP2C9 | |
| SCHEMBL15757587 | 0.83 | CYP3A4 (0.45) | CYP2D6ALDH1A1CYP3A4TSHRCYP2C9 | |
| SCHEMBL15758265 | 0.82 | ALDH1A1 (0.46) | CYP2D6ALDH1A1CYP3A4TSHRCYP2C9 | |
| SCHEMBL730472 | 0.82 | PTGIR (0.46) | CYP2D6ALDH1A1CYP3A4TSHRCYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3230281-B1 | 1,3-THIAZOL-2-YL SUBSTITUTED BENZAMIDES | BAYER AG (DE) | 2021-05-26 | — | — | EP | disclosed |
| EP-0138539-B1 | 2-AZACYCLOALKYLTHIOPENEM DERIVATIVES | PFIZER INC. (US) | 1989-03-15 | — | — | EP | disclosed |
| US-4772597-A | ANTIBIOTICS | PFIZER INC. (US) | 1988-09-20 | — | — | US | disclosed |
| EP-0138539-A1 | 2-Azacycloalkylthiopenem derivatives | PFIZER INC. (US) | 1985-04-24 | — | — | EP | disclosed |