Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.31 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | LOX | P28300 | 1/20 | 0.30 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | XDH | P47989 | 1/20 | 0.30 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21611947 | 0.75 | PPARD (0.40) | RAB9ANPC1LOXLOXL2 | |
| SCHEMBL21611990 | 0.74 | GRIN1 (0.43) | RAB9ACHEK2NPC1GRIN1GRIN2B | |
| SCHEMBL21611964 | 0.71 | CYP3A4 (0.50) | GRIN1GRIN2B | |
| SCHEMBL21611965 | 0.66 | GRIN1 (0.35) | RAB9ANPC1KDM4EGAAGRIN1 | |
| SCHEMBL21614659 | 0.66 | GRIN1 (0.34) | RAB9ACHEK2NPC1SCN9AGRIN1 | |
| SCHEMBL21614758 | 0.65 | SMN1; SMN2 (0.34) | RAB9ASCN9AKDM4E | |
| SCHEMBL21614676 | 0.65 | ALDH1A1 (0.39) | GAA | |
| SCHEMBL21611931 | 0.60 | — | — | |
| SCHEMBL24027547 | 0.59 | RAB9A (0.44) | RAB9ANPC1GAAGRIN1GRIN2B | |
| SCHEMBL24027392 | 0.59 | NPC1 (0.43) | RAB9ANPC1GRIN1GRIN2B |
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-2020007938-A1 | PqsR INVERSE AGONISTS | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2020-01-09 | — | — | WO | disclosed |