Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | KDR | P35968 | 10/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31142923 | 1.00 | DRD4 (0.51) | DRD4DRD3L3MBTL1KDRMAPT | |
| SCHEMBL9732163 | 0.86 | DRD4 (0.53) | DRD4DRD3L3MBTL1KDRMAPT | |
| SCHEMBL14112776 | 0.79 | DRD4 (0.48) | DRD4DRD3L3MBTL1KDRMAPT | |
| SCHEMBL788752 | 0.78 | DRD4 (0.61) | DRD4DRD3L3MBTL1KDRMAPT | |
| SCHEMBL12014771 | 0.78 | DRD4 (0.47) | DRD4DRD3L3MBTL1KDRMAPT | |
| SCHEMBL15471345 | 0.78 | DRD4 (0.61) | DRD4DRD3L3MBTL1KDRMAPT | |
| SCHEMBL26529514 | 0.78 | LMNA (0.47) | DRD4DRD3L3MBTL1KDRMAPT | |
| SCHEMBL717333 | 0.77 | DRD4 (0.59) | DRD4DRD3L3MBTL1KDRMAPT | |
| SCHEMBL458716 | 0.77 | KDR (0.54) | DRD4DRD3L3MBTL1KDRMAPT | |
| SCHEMBL1887979 | 0.77 | DRD4 (0.59) | DRD4DRD3L3MBTL1KDRMAPT |
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 |