Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL5794600 | 0.95 | CTSL (0.41) | CTSLCTSBCTSSCTSKMEN1 | |
| SCHEMBL8270696 | 0.88 | CTSL (0.47) | CTSLCTSBCTSSCTSKKMT2A | |
| SCHEMBL5791389 | 0.88 | CTSL (0.46) | CTSLCTSBCTSSCTSKMEN1 | |
| SCHEMBL8268811 | 0.87 | TAS1R3 (0.40) | CTSLCTSBCTSSCTSKMEN1 | |
| SCHEMBL8271448 | 0.86 | CTSK (0.46) | CTSLCTSKMEN1KMT2ARAB9A | |
| SCHEMBL8269989 | 0.85 | NPC1 (0.44) | MEN1KMT2ALMNARAB9AALDH1A1 | |
| SCHEMBL8270727 | 0.85 | ANO1 (0.39) | CTSLCTSBCTSSCTSKMEN1 | |
| Trifluoroacetic Acid SCHEMBL5794693 | 0.84 | TSHR (0.38) | CTSLCTSBCTSSCTSKMEN1 | |
| Trifluoroacetic Acid SCHEMBL5794344 | 0.83 | CTSL (0.43) | CTSLCTSBCTSSCTSKALDH1A1 | |
| SCHEMBL8269396 | 0.82 | CTSK (0.45) | CTSLCTSBCTSSCTSKLMNA |
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-2006027211-A1 | 2,4-SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2006-03-16 | — | — | WO | disclosed |