Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 2/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | PHGDH | O43175 | 1/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL7718575 | 0.82 | KMT2A (0.37) | ALDH1A1KMT2ARAB9ALMNAMAPT | |
| SCHEMBL7718536 | 0.77 | — | — | |
| SCHEMBL10042012 | 0.75 | ALDH1A1 (0.41) | ALDH1A1KMT2ARAB9ALMNAMAPT | |
| SCHEMBL1994023 | 0.75 | ALDH1A1 (0.41) | ALDH1A1KMT2ARAB9ALMNAMAPT | |
| SCHEMBL7719093 | 0.75 | FDPS (0.31) | — | |
| SCHEMBL5911022 | 0.74 | ALDH1A1 (0.38) | ALDH1A1KMT2ARAB9ALMNAMAPT | |
| SCHEMBL23108665 | 0.73 | KMT2A (0.42) | ALDH1A1KMT2ARAB9ALMNAMAPT | |
| SCHEMBL643674 | 0.73 | KMT2A (0.42) | ALDH1A1KMT2ARAB9ALMNAMAPT | |
| SCHEMBL21564194 | 0.73 | KMT2A (0.42) | ALDH1A1KMT2ARAB9ALMNAMAPT | |
| SCHEMBL6309156 | 0.73 | ALDH1A1 (0.37) | ALDH1A1KMT2ARAB9ALMNAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002087587-A2 | 4-AMINOSULFONYLQUINAZOLINES AND -QUINOLINES AS TYROSINE KINASE INHIBITORS | CELLTECH R & D LIMITED (GB) | 2002-11-07 | — | — | WO | disclosed |
| US-4281118-A | Aminoalkylsulfides, aminoalkylsulfoxides, and aminoalkylsulfones | THE DOW CHEMICAL COMPANY (US) | 1981-07-28 | — | — | US | disclosed |
| US-4281118-A | Aminoalkylsulfides, aminoalkylsulfoxides, and aminoalkylsulfones | THE DOW CHEMICAL COMPANY (US) | 1981-07-28 | — | — | US | disclosed |