Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.60 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.60 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.56 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.56 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 7/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 7/20 | 0.47 |
| ▸ | PRKG1 | Q13976 | 4/20 | 0.47 |
| ▸ | PRKACA | P17612 | 4/20 | 0.47 |
| ▸ | GSK3A | P49840 | 4/20 | 0.47 |
| ▸ | GSK3B | P49841 | 4/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.47 |
| ▸ | PRKX | P51817 | 3/20 | 0.47 |
| ▸ | PRKCQ | Q04759 | 3/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1050770 | 0.89 | CASR (0.54) | CYP3A4CASRALDH1A1MTNR1AMTNR1B | |
| Benzene SCHEMBL11146992 | 0.89 | CASR (0.54) | CYP3A4CASRALDH1A1MTNR1AMTNR1B | |
| SCHEMBL13295542 | 0.88 | CASR (0.53) | CYP3A4CASRALDH1A1MTNR1AMTNR1B | |
| SCHEMBL14205688 | 0.88 | CASR (0.53) | CYP3A4CASRALDH1A1MTNR1AMTNR1B | |
| SCHEMBL11606368 | 0.84 | SLC6A2 (0.67) | SLC6A2SLC6A4SLC6A3CYP19A1CYP11B1 | |
| SCHEMBL23882848 | 0.80 | ROCK1 (0.50) | ROCK1ROCK2PRKG1PRKACAGSK3A | |
| SCHEMBL4025059 | 0.80 | AOC3 (0.51) | ROCK1ROCK2PRKG1PRKACAGSK3A | |
| SCHEMBL23882846 | 0.80 | ROCK1 (0.50) | ROCK1ROCK2PRKG1PRKACAGSK3A | |
| SCHEMBL28557150 | 0.80 | SLC6A3 (0.64) | SLC6A2SLC6A4SLC6A3CLK4CYP3A4 | |
| SCHEMBL30638827 | 0.80 | SLC6A3 (0.64) | SLC6A2SLC6A4SLC6A3CLK4CYP3A4 |
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-4138488-A | Diphenylmethyl picolinic acid derivatives and their use as anti-acne agents | SCHERING CORPORATION (US) | 1979-02-06 | — | — | US | disclosed |