Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | CCR1 | P32246 | 3/20 | 0.34 |
| ▸ | CCR8 | P51685 | 2/20 | 0.34 |
| ▸ | CCR5 | P51681 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL31143096 | 1.00 | PPARA (0.36) | PPARAMAPTCCR1CCR8CCR5 | |
| SCHEMBL9730937 | 0.86 | ALDH1A1 (0.35) | PPARAMAPTCCR1CCR8CCR5 | |
| SCHEMBL3877857 | 0.78 | MEN1 (0.35) | PPARAMAPTCCR1CCR8CCR5 | |
| SCHEMBL31490208 | 0.74 | CCR1 (0.61) | MAPTCCR1CCR5L3MBTL1KDM4E | |
| SCHEMBL9186312 | 0.74 | CCR1 (0.61) | MAPTCCR1CCR5L3MBTL1KDM4E | |
| SCHEMBL31142923 | 0.73 | DRD4 (0.51) | MAPTL3MBTL1ALDH1A1NPC1KDM4E | |
| SCHEMBL24971012 | 0.73 | DRD4 (0.51) | MAPTL3MBTL1ALDH1A1NPC1KDM4E | |
| SCHEMBL7025162 | 0.72 | CCR1 (0.45) | PPARAMAPTCCR1CCR8CCR5 | |
| SCHEMBL6888604 | 0.72 | CCR1 (0.67) | PPARAMAPTCCR1CCR8CCR5 | |
| SCHEMBL29890061 | 0.72 | CCR1 (0.67) | PPARAMAPTCCR1CCR8CCR5 |
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-2023002011-A1 | GRAM-NEGATIVE BACTERIA EFFLUX PUMP INHIBITORS | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2023-01-26 | — | — | WO | disclosed |