Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDGFRB | P09619 | 6/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 6/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.32 |
| ▸ | ITGAV | P06756 | 1/20 | 0.32 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.32 |
| ▸ | ITGB8 | P26012 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20023729 | 0.85 | PDGFRB (0.41) | PDGFRBPDGFRACYP11B1CYP11B2ITGAV | |
| SCHEMBL29689482 | 0.85 | PDGFRB (0.41) | PDGFRBPDGFRACYP11B1CYP11B2ITGAV | |
| SCHEMBL16743121 | 0.78 | PDGFRB (0.47) | PDGFRBPDGFRAITGAVITGB6ITGB8 | |
| SCHEMBL15686689 | 0.78 | PDGFRB (0.40) | PDGFRBPDGFRACYP11B1CYP11B2ITGAV | |
| SCHEMBL10199417 | 0.76 | NPC1 (0.44) | — | |
| SCHEMBL11322091 | 0.74 | OGA (0.40) | KCNH2 | |
| SCHEMBL13356608 | 0.74 | ALDH1A1 (0.33) | KCNH2HRH4HRH3 | |
| SCHEMBL13356681 | 0.74 | OGA (0.37) | KCNH2HRH4HRH3AKR1C3AKR1C2 | |
| SCHEMBL12938113 | 0.74 | UGT2B7 (0.39) | KCNH2 | |
| SCHEMBL8285389 | 0.74 | CYP1A2 (0.50) | PDGFRBPDGFRACYP11B1CYP11B2 |
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-1773330-B1 | SUBSTITUTED PYRAZOLES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE | MERCK SHARP & DOHME (US) | 2010-05-26 | — | — | EP | disclosed |