Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.37 |
| ▸ | SRC | P12931 | 4/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 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 | |
|---|---|---|---|---|
| SCHEMBL8708455 | 1.00 | CYP3A4 (0.44) | CYP3A4TP53ALOX15TSHRMAPK1 | |
| SCHEMBL9068225 | 0.94 | PTGER1 (0.40) | CYP3A4TP53ALOX15TSHRMAPK1 | |
| SCHEMBL8704219 | 0.91 | CYP3A4 (0.46) | CYP3A4TP53ALOX15TSHRMAPK1 | |
| SCHEMBL8702993 | 0.87 | ABCB1 (0.50) | CYP3A4TP53ALOX15TSHRMAPK1 | |
| SCHEMBL8706554 | 0.83 | KLK7 (0.45) | TSHRNR1H2NR1H3SCN1ASCN2A | |
| SCHEMBL8706557 | 0.83 | KLK7 (0.45) | TSHRNR1H2NR1H3SCN1ASCN2A | |
| SCHEMBL4603500 | 0.82 | POLB (0.42) | CYP3A4TSHRCYP1A2POLBCYP2C19 | |
| SCHEMBL2201807 | 0.82 | POLB (0.42) | CYP3A4TSHRCYP1A2POLBCYP2C19 | |
| SCHEMBL29007851 | 0.82 | POLB (0.42) | CYP3A4CYP1A2POLBCYP2C19ABCB1 | |
| SCHEMBL8059551 | 0.82 | CYP1A2 (0.45) | CYP3A4CYP1A2POLBCYP2C19NR1H2 |
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-0844000-A1 | Use of alpha, omega-diarylalkane derivatives in the treatment and prevention of psychosis | SANKYO COMPANY LIMITED (JP) | 1998-05-27 | — | — | EP | disclosed |