Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | FPR2 | P25090 | 2/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
| ▸ | LPL | P06858 | 1/20 | 0.34 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | GAK | O14976 | 1/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 4/20 | 0.32 |
| ▸ | PDGFRA | P16234 | 4/20 | 0.32 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | TDO2 | P48775 | 2/20 | 0.32 |
| ▸ | ACACA | Q13085 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23956204 | 0.84 | LIPG (0.41) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL23956229 | 0.81 | KDM4E (0.62) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL21290177 | 0.78 | IDO1 (0.45) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL21290169 | 0.77 | NPC1 (0.52) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL21290302 | 0.74 | MAPT (0.41) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL26050415 | 0.74 | EGFR (0.43) | ALDH1A1KDM4EEGFRFPR2LPL | |
| SCHEMBL21290168 | 0.72 | ACACA (0.65) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL25100914 | 0.72 | DGAT1 (0.37) | SMN1; SMN2KDM4ERAB9AEGFRDGAT1 | |
| SCHEMBL21289786 | 0.71 | ERN1 (0.43) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL21290301 | 0.70 | FPR2 (0.39) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A |
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-2019158453-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2019-08-22 | — | — | WO | disclosed |