Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.53 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.53 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.44 |
| ▸ | CSF1R | P07333 | 1/20 | 0.44 |
| ▸ | RET | P07949 | 1/20 | 0.44 |
| ▸ | MET | P08581 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL15009060 | 0.85 | ALDH1A1 (0.57) | KEAP1NFE2L2ALDH3A1CA9MAPT | |
| SCHEMBL28704611 | 0.84 | MAPT (0.64) | CA9MAPTALDH1A1TDP1LMNA | |
| SCHEMBL15009245 | 0.73 | MAPT (0.51) | CA9MAPTALDH1A1TDP1NPSR1 | |
| SCHEMBL6364323 | 0.72 | MAPT (0.50) | ALDH3A1MAPTALDH1A1NPSR1KMT2A | |
| SCHEMBL14676341 | 0.71 | HCAR3 (0.58) | MAPTALDH1A1TDP1LMNAMAPK1 | |
| SCHEMBL6553223 | 0.71 | MAPT (0.59) | MAPTALDH1A1TDP1LMNAKDR | |
| SCHEMBL28186748 | 0.71 | MAPT (0.54) | MAPTALDH1A1TDP1LMNACRHBP | |
| SCHEMBL21708265 | 0.70 | MAPT (0.62) | KEAP1NFE2L2ALDH3A1MAPTALDH1A1 | |
| SCHEMBL2006238 | 0.70 | MAPT (0.72) | KEAP1NFE2L2CA9MAPTALDH1A1 | |
| SCHEMBL30557374 | 0.70 | MAPT (0.72) | KEAP1NFE2L2CA9MAPTALDH1A1 |
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-2013090227-A1 | BENZISOTHIAZOL-3(1H)-ONE-5-SULFONYL DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS | ALLERGAN, INC. (US) | 2013-06-20 | — | — | WO | disclosed |