Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.43 |
| ▸ | SCN1A | P35498 | 1/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.42 |
| ▸ | UBE2M | P61081 | 1/20 | 0.41 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.40 |
| ▸ | ICMT | O60725 | 1/20 | 0.39 |
| ▸ | ALB | P02768 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL9269480 | 1.00 | CYP3A4 (0.44) | CYP3A4CYP2D6KCNH2SCN3ASCN1A | |
| SCHEMBL9273330 | 0.88 | CYP3A4 (0.41) | CYP3A4CYP2D6KCNH2SCN3ASCN1A | |
| SCHEMBL9273333 | 0.88 | CYP3A4 (0.41) | CYP3A4CYP2D6KCNH2SCN3ASCN1A | |
| SCHEMBL9273248 | 0.84 | EPHX1 (0.42) | CYP3A4CYP2D6KCNH2SCN3ASCN1A | |
| SCHEMBL9273251 | 0.84 | EPHX1 (0.42) | CYP3A4CYP2D6KCNH2SCN3ASCN1A | |
| SCHEMBL9270471 | 0.80 | MEN1 (0.43) | EPHX1LMNAALDH1A1POLBMAPT | |
| SCHEMBL9269097 | 0.80 | DCUN1D1 (0.48) | EPHX1UBE2MDCUN1D1 | |
| SCHEMBL9266431 | 0.77 | NPSR1 (0.43) | EPHX1LMNAALDH1A1ALOX12POLB | |
| SCHEMBL9266428 | 0.77 | NPSR1 (0.43) | EPHX1LMNAALDH1A1ALOX12POLB | |
| SCHEMBL9269084 | 0.77 | PPARG (0.53) | POLB |
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-5420164-A | Enzyme inhibitors | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1995-05-30 | — | — | US | disclosed |