Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9823513 | 0.87 | GABRA1 (0.40) | CYP1A2CYP3A4GABRA1GABRB2CYP11B1 | |
| SCHEMBL9823393 | 0.82 | ALDH1A1 (0.50) | CYP1A2CYP3A4GABRA1GABRB2CYP11B1 | |
| SCHEMBL9823414 | 0.80 | MAPK1 (0.51) | CYP1A2CYP3A4GABRA1GABRB2CYP11B1 | |
| Water SCHEMBL9823540 | 0.77 | GABRA1 (0.37) | CYP1A2CYP3A4GABRA1GABRB2CYP11B1 | |
| SCHEMBL9823451 | 0.70 | ALDH1A1 (0.49) | CYP1A2CYP3A4GABRA1GABRB2CYP11B1 | |
| SCHEMBL11332342 | 0.69 | ALDH1A1 (0.47) | CYP1A2CYP3A4GABRA1GABRB2CYP11B1 | |
| SCHEMBL9823378 | 0.69 | ALDH1A1 (0.51) | CYP1A2CYP3A4GABRA1GABRB2CYP11B1 | |
| SCHEMBL11561139 | 0.69 | CYP19A1 (0.45) | CYP1A2CYP3A4GABRA1GABRB2CYP11B1 | |
| Hydrochloric Acid SCHEMBL9509396 | 0.68 | MC4R (0.34) | MC4RCYP17A1 | |
| SCHEMBL9823554 | 0.67 | MAPK1 (0.52) | CYP1A2CYP3A4GABRA1GABRB2CYP11B1 |
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-0240050-B1 | A METHOD FOR CONTROLLING WEEDS | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-06-26 | — | — | EP | claimed |