Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.67 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | MAOA | P21397 | 1/20 | 0.60 |
| ▸ | MAOB | P27338 | 1/20 | 0.60 |
| ▸ | CA12 | O43570 | 2/20 | 0.58 |
| ▸ | CA1 | P00915 | 2/20 | 0.58 |
| ▸ | CA2 | P00918 | 2/20 | 0.58 |
| ▸ | CA9 | Q16790 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | EGFR | P00533 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | TERT | O14746 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL14136252 | 0.93 | PTGS2 (0.77) | PTGS2NPC1RAB9AMAOAMAOB | |
| SCHEMBL14133489 | 0.91 | KDM4E (0.64) | PTGS2NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL14136239 | 0.90 | PTGS2 (0.71) | PTGS2NPC1RAB9AKDM4EMAOA | |
| SCHEMBL14058064 | 0.89 | PTGS2 (0.70) | PTGS2NPC1RAB9AMAOAMAOB | |
| SCHEMBL14133910 | 0.89 | PTGS2 (0.69) | PTGS2NPC1RAB9AMAOAMAOB | |
| SCHEMBL14136236 | 0.89 | PTGS2 (0.69) | PTGS2NPC1RAB9AKDM4EMAOA | |
| SCHEMBL14058025 | 0.87 | NPC1 (0.78) | PTGS2NPC1RAB9AMAOAMAOB | |
| SCHEMBL14133795 | 0.86 | KDM4E (0.80) | PTGS2NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL14136234 | 0.84 | PTGS2 (0.76) | PTGS2KDM4EMAOAMAOBCA12 | |
| SCHEMBL14146846 | 0.84 | ALDH1A1 (0.57) | PTGS2NPC1RAB9AKDM4ESMN1; 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-2012160447-A1 | 3, 5 -DIPHENYL- SUBSTITUTED PYRAZOLINES FOR THE TREATMENT OF CANCER, PROLIFERATIVE, INFLAMMATORY OR AUTOIMMUNE DISEASES | DYNAMIX PHARMACEUTICALS LTD. (IL) | 2012-11-29 | — | — | WO | disclosed |