Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.56 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.41 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 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 | |
|---|---|---|---|---|
| SCHEMBL18736193 | 0.83 | ALDH1A1 (0.41) | ALDH1A1HPGDMAPTSMN1; SMN2GAA | |
| SCHEMBL18401230 | 0.82 | ALDH1A1 (0.49) | ALDH1A1HPGDMAPTSMN1; SMN2GAA | |
| SCHEMBL14129295 | 0.82 | ALDH1A1 (0.41) | ALDH1A1HPGDMAPTSMN1; SMN2GAA | |
| SCHEMBL3976381 | 0.78 | ALDH1A1 (0.58) | ALDH1A1HPGDMAPTSMN1; SMN2GAA | |
| SCHEMBL14516988 | 0.77 | APP (0.49) | ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL13411544 | 0.76 | ALDH1A1 (0.55) | ALDH1A1HPGDMAPTSMN1; SMN2GAA | |
| SCHEMBL17469336 | 0.75 | ALDH1A1 (0.64) | ALDH1A1HPGDMAPTSMN1; SMN2GAA | |
| SCHEMBL19997538 | 0.75 | ALDH1A1 (0.55) | ALDH1A1HPGDMAPTSMN1; SMN2GAA | |
| SCHEMBL14129442 | 0.75 | HPGD (0.66) | ALDH1A1HPGDMAPTSMN1; SMN2GAA | |
| SCHEMBL649272 | 0.74 | IDO1 (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7396828-B2 | PI-3 kinase inhibitor prodrugs | SEMAFORE PHARMACEUTICALS, INC. (US) | 2008-07-08 | — | — | US | disclosed |