Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 9/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.63 |
| ▸ | CA9 | Q16790 | 3/20 | 0.61 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.59 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.59 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.55 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.55 |
| ▸ | CA2 | P00918 | 2/20 | 0.55 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.54 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.54 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.53 |
| ▸ | PTGES | O14684 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | PDE5A | O76074 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9204576 | 0.90 | PTGS2 (0.59) | PTGS2CYP2C9SMN1; SMN2PTGS1ALOX5 | |
| SCHEMBL6351159 | 0.90 | CA9 (0.74) | PTGS2CYP2C9CA9HDAC3HDAC1 | |
| SCHEMBL9199556 | 0.89 | AOC3 (0.65) | PTGS2CYP2C9PTGS1CHRNA7 | |
| SCHEMBL9209551 | 0.89 | ALOX5 (0.60) | PTGS2CA9ALOX5CHRNA7 | |
| SCHEMBL10147881 | 0.89 | SMN1; SMN2 (0.71) | PTGS2CYP2C9CA9HDAC3HDAC1 | |
| SCHEMBL9209000 | 0.89 | SMN1; SMN2 (0.71) | PTGS2CYP2C9CA9HDAC3HDAC1 | |
| SCHEMBL8925566 | 0.88 | CHRNA7 (0.57) | PTGS2CYP2C9SMN1; SMN2ALOX5CHRNA7 | |
| SCHEMBL8925594 | 0.88 | RARG (0.60) | PTGS2SMN1; SMN2ALOX5CHRNA7 | |
| SCHEMBL9208261 | 0.88 | CHRNA7 (0.51) | PTGS2CYP2C9SMN1; SMN2ALOX5CHRNA7 | |
| SCHEMBL9199063 | 0.87 | CHRNA7 (0.66) | PTGS2CA9SMN1; SMN2PTGS1CA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0418845-B1 | Pyrazole derivatives, processes for preparation thereof and pharmaceutical composition comprising the same | FUJISAWA PHARMACEUTICAL CO (JP) | 1995-08-09 | — | — | EP | disclosed |
| EP-0418845-A1 | Pyrazole derivatives, processes for preparation thereof and pharmaceutical composition comprising the same | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1991-03-27 | — | — | EP | disclosed |