Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 13/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL10946163 | 0.81 | KDM4E (0.36) | P2RX7RAB9AKDM4EALDH1A1TP53 | |
| SCHEMBL10737804 | 0.79 | ALDH1A1 (0.43) | RAB9AKDM4EALDH1A1 | |
| SCHEMBL10943621 | 0.78 | PTGS2 (0.37) | P2RX7PTGS2PDK1 | |
| SCHEMBL10660330 | 0.74 | NPC1 (0.41) | RAB9APTGS2KDM4EALDH1A1 | |
| SCHEMBL10353499 | 0.74 | RAB9A (0.43) | RAB9AKDM4EALDH1A1TP53 | |
| SCHEMBL10660829 | 0.72 | HSPA5 (0.44) | KDM4EALDH1A1 | |
| SCHEMBL10730710 | 0.72 | HSPA5 (0.44) | RAB9AKDM4EALDH1A1 | |
| SCHEMBL10731544 | 0.72 | HSPA5 (0.42) | RAB9AKDM4EALDH1A1 | |
| SCHEMBL10944135 | 0.70 | ALDH1A1 (0.44) | RAB9AKDM4EALDH1A1 | |
| SCHEMBL10660936 | 0.70 | CYP1A2 (0.43) | RAB9AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4518775-A | Benzoxazine-4-one intermediates | ROUSSEL UCLAF (FR) | 1985-05-21 | — | — | US | disclosed |
| US-4397856-A | Analgesic 4-hydroxy-3-quinolinecarboxamides | ROUSSEL UCLAF (FR) | 1983-08-09 | — | — | US | disclosed |