Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | COMT | P21964 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.33 |
| ▸ | CSNK1D | P48730 | 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 | |
|---|---|---|---|---|
| SCHEMBL15885979 | 0.76 | CHRNB2 (0.41) | CHRNB2CHRNA4PIK3CDMEN1KMT2A | |
| SCHEMBL27894903 | 0.76 | NTRK1 (0.46) | KMT2AALDH1A1MAPK13CSNK1DCSNK1E | |
| SCHEMBL8108697 | 0.75 | SLC34A1 (0.38) | AKR1C3AKR1C2CHRNB2CHRNA4PIK3CD | |
| SCHEMBL31626630 | 0.73 | SMN1; SMN2 (0.46) | CHRNB2CHRNA4PIK3CDMEN1KMT2A | |
| SCHEMBL8110495 | 0.72 | KCNH2 (0.40) | CHRNB2CHRNA4PIK3CDMEN1KMT2A | |
| SCHEMBL6430247 | 0.72 | CYP2A6 (0.49) | CYP2A6 | |
| SCHEMBL28177579 | 0.69 | LRRK2 (0.37) | KCNH2NPC1RAB9A | |
| SCHEMBL22165900 | 0.69 | MEN1 (0.46) | MEN1KMT2A | |
| SCHEMBL29429387 | 0.69 | MEN1 (0.46) | MEN1KMT2A | |
| SCHEMBL8108308 | 0.69 | MAPT (0.44) | AKR1C3AKR1C2CHRNB2CHRNA4PIK3CD |
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 |
|---|---|---|---|---|---|---|---|
| CN-106317056-A | Pyrazolopyridine derivatives, preparation process therefor and therapeutic use thereof | 赛诺菲 | 2017-01-11 | — | — | CN | disclosed |