Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | KDM5A | P29375 | 2/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.40 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | RPA1 | P27694 | 2/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7874517 | 0.83 | RPA1 (0.43) | PTGS2PTGS1MAPTRAB9AALDH1A1 | |
| SCHEMBL7867813 | 0.81 | PTGS2 (0.44) | PTGS2PTGS1MAPTRAB9AALDH1A1 | |
| SCHEMBL8197096 | 0.81 | PTGS2 (0.41) | PTGS2PTGS1KDM5AKDM4CKDM5B | |
| SCHEMBL7878967 | 0.78 | PTGS2 (0.61) | PTGS2PTGS1ALDH1A1RPA1 | |
| SCHEMBL8202090 | 0.76 | PTGS2 (0.46) | PTGS2PTGS1KDM5AKDM4CKDM5B | |
| SCHEMBL13736684 | 0.76 | NR3C2 (0.39) | KDM5AKDM4CKDM5BMAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL8202135 | 0.75 | PTGS2 (0.46) | PTGS2PTGS1KDM5AKDM4CKDM5B | |
| SCHEMBL16910970 | 0.74 | ALDH1A1 (0.48) | MAPTRAB9AALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL8200032 | 0.74 | PTGS2 (0.45) | PTGS2PTGS1KDM5AKDM4CKDM5B | |
| SCHEMBL27932702 | 0.74 | NR3C2 (0.51) | PTGS2PTGS1MAPTALDH1A1SMN1; SMN2 |
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-2000018741-A2 | PYRAZOLE COMPOUNDS AS COX-2 INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-04-06 | — | — | WO | disclosed |