Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 1.00 |
| ▸ | CYP2C9 | P11712 | 1/20 | 1.00 |
| ▸ | GAA | P10253 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28921245 | 0.80 | CYP1A2 (0.67) | CYP1A2CYP2C9GAAALDH1A1LMNA | |
| SCHEMBL18766625 | 0.80 | CYP1A2 (0.67) | CYP1A2CYP2C9ALDH1A1LMNAMAPK1 | |
| SCHEMBL1356256 | 0.80 | CYP1A2 (0.67) | CYP1A2CYP2C9KDM4EALDH1A1LMNA | |
| SCHEMBL5253694 | 0.80 | CYP1A2 (0.67) | CYP1A2CYP2C9GAAKDM4EALDH1A1 | |
| SCHEMBL15828608 | 0.80 | CYP1A2 (0.66) | CYP1A2CYP2C9GAAKDM4EALDH1A1 | |
| SCHEMBL18785961 | 0.73 | CYP1A2 (0.56) | CYP1A2CYP2C9 | |
| SCHEMBL29018907 | 0.72 | CYP1A2 (0.57) | CYP1A2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL10238918 | 0.72 | CYP1A2 (0.56) | CYP1A2CYP2C9GAAKDM4EGLA | |
| SCHEMBL12789891 | 0.71 | CYP1A2 (0.55) | CYP1A2CYP2C9GAAKDM4EGLA | |
| SCHEMBL30217955 | 0.70 | CYP1A2 (0.53) | CYP1A2CYP2C9KDM4EALDH1A1LMNA |
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-3318557-A2 | QUINOLONE COMPOUND | Otsuka Pharmaceutical Co., Ltd. (JP) | 2018-05-09 | — | — | EP | disclosed |