Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 18/20 | 0.85 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL6057883 | 0.92 | LCK (1.00) | LCKALDH1A1NPC1LMNARAB9A | |
| Trifluoroacetic Acid SCHEMBL6058261 | 0.84 | LCK (0.59) | LCKHSD17B10 | |
| Trifluoroacetic Acid SCHEMBL6058451 | 0.84 | LCK (0.60) | LCKALDH1A1NPC1LMNARAB9A | |
| SCHEMBL6058160 | 0.83 | LCK (0.82) | LCKALDH1A1NPC1LMNARAB9A | |
| SCHEMBL6057811 | 0.80 | LCK (0.84) | LCK | |
| Trifluoroacetic Acid SCHEMBL6058339 | 0.80 | LCK (0.54) | LCKHSD17B10 | |
| Dimethylamine SCHEMBL6058137 | 0.79 | LCK (0.74) | LCKALDH1A1NPC1LMNARAB9A | |
| SCHEMBL6058178 | 0.77 | LCK (0.80) | LCK | |
| SCHEMBL6058027 | 0.77 | LCK (1.00) | LCK | |
| SCHEMBL6058139 | 0.77 | LCK (0.87) | LCK |
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-1037632-B1 | BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2006-01-11 | — | — | EP | claimed |