Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.43 |
| ▸ | RAF1 | P04049 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.43 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.41 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | MLLT3 | P42568 | 1/20 | 0.38 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8887621 | 0.85 | CYP1A2 (0.50) | CYP1A2MAPK14GPR119HPGDKDM4E | |
| SCHEMBL8887885 | 0.85 | CYP1A2 (0.50) | CYP1A2MAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL8888361 | 0.85 | CYP1A2 (0.50) | CYP1A2MAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL8889484 | 0.82 | CYP1A2 (0.53) | CYP1A2MAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL8889663 | 0.82 | CYP1A2 (0.47) | CYP1A2GPR119HPGDKDM4EALDH1A1 | |
| SCHEMBL8886941 | 0.82 | NR1H2 (0.49) | CYP1A2MAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL8897726 | 0.80 | JAK2 (0.46) | CYP1A2MAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL8888926 | 0.80 | KMT2A (0.57) | CYP1A2GPR119HPGDKDM4EALDH1A1 | |
| SCHEMBL8888295 | 0.80 | CYP1A2 (0.53) | CYP1A2MAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL8889786 | 0.80 | CYP1A2 (0.45) | CYP1A2MAPK11MAPK14GPR119HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997001551-A1 | PYRAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-01-16 | — | — | WO | disclosed |