Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1269231 | 0.85 | MAPK1 (0.39) | MAPK1ALDH1A1ALOX15CYP2D6DRD2 | |
| SCHEMBL20176041 | 0.78 | CYP2D6 (0.35) | MAPK1ALDH1A1ALOX15CYP2D6DRD2 | |
| SCHEMBL22160044 | 0.75 | MAPK1 (0.43) | MAPK1ALDH1A1ALOX15CYP3A4TAAR1 | |
| SCHEMBL6563216 | 0.75 | KIF11 (0.32) | — | |
| SCHEMBL9257656 | 0.72 | MAPK1 (0.40) | MAPK1ALDH1A1ALOX15CYP2D6CYP3A4 | |
| SCHEMBL6724604 | 0.70 | CASR (0.37) | ALDH1A1CYP2D6CYP3A4GRM1 | |
| SCHEMBL3707975 | 0.69 | CYP2C19 (0.44) | MAPK1ALDH1A1ALOX15CYP2D6DRD2 | |
| SCHEMBL28451515 | 0.69 | TSHR (0.40) | ALDH1A1 | |
| SCHEMBL21110640 | 0.69 | MAPK1 (0.38) | MAPK1ALDH1A1ALOX15CYP3A4TAAR1 | |
| SCHEMBL3707976 | 0.69 | CYP2C19 (0.44) | MAPK1ALDH1A1ALOX15CYP2D6DRD2 |
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-5514711-A | ANTICARCINOGENIC AGENTS; SIDE EFFECT REDUCTION | MITSUBISHI CHEMICAL CORPORATION (JP) | 1996-05-07 | — | — | US | disclosed |