Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.35 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.35 |
| ▸ | CCNC | P24863 | 1/20 | 0.34 |
| ▸ | CDK8 | P49336 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | PLK1 | P53350 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL721270 | 0.80 | PTPN11 (0.54) | HDAC1ENPP3ENPP1CCNCCDK8 | |
| SCHEMBL19937783 | 0.76 | ALDH1A1 (0.38) | ENPP3ENPP1HTTALDH1A1MAPT | |
| SCHEMBL19937802 | 0.75 | ALDH1A1 (0.34) | ENPP3ENPP1HTTALDH1A1MAPT | |
| SCHEMBL19938115 | 0.74 | SMN1; SMN2 (0.35) | ENPP3ENPP1HTTALDH1A1MAPT | |
| SCHEMBL19937629 | 0.71 | ALDH1A1 (0.34) | ENPP3ENPP1HTTALDH1A1MAPT | |
| SCHEMBL720603 | 0.68 | PTPN11 (0.55) | ENPP3ENPP1PTPN11SCN9AALDH1A1 | |
| SCHEMBL31318223 | 0.67 | DYRK1A (0.61) | MAPK1KDREGFRJAK2JAK3 | |
| SCHEMBL30215940 | 0.67 | PTPN11 (0.54) | ENPP3ENPP1PTPN11CHEK2SCN9A | |
| SCHEMBL31396616 | 0.67 | PTPN11 (0.53) | ENPP3ENPP1PTPN11HTTALDH1A1 | |
| SCHEMBL23262655 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2925319-B1 | MIXED LINEAGE KINASE INHIBITORS FOR HIV/AIDS THERAPIES | UNIV ROCHESTER (US) | 2019-01-09 | — | — | EP | disclosed |