Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 3/20 | 0.43 |
| ▸ | CTSS | P25774 | 2/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HRH2 | P25021 | 2/20 | 0.36 |
| ▸ | HRH1 | P35367 | 2/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.34 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.34 |
| ▸ | ANPEP | P15144 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8270726 | 0.94 | CTSK (0.45) | CTSKCTSSCTSLCTSBALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5791179 | 0.91 | CTSK (0.42) | CTSKCTSSCTSLALDH1A1MAPT | |
| Trifluoroacetic Acid SCHEMBL5791713 | 0.89 | CTSK (0.37) | CTSKCTSSCTSLCTSBHRH4 | |
| Trifluoroacetic Acid SCHEMBL5791900 | 0.87 | CTSK (0.44) | CTSKCTSSCTSLCTSBALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5794085 | 0.86 | CTSS (0.36) | CTSKCTSSCTSLCTSBHRH4 | |
| Trifluoroacetic Acid SCHEMBL5791565 | 0.85 | CTSK (0.35) | CTSKCTSSCTSLCTSBALDH1A1 | |
| SCHEMBL8270720 | 0.85 | CTSK (0.43) | CTSKCTSSCTSLALDH1A1MAPT | |
| Trifluoroacetic Acid SCHEMBL5794377 | 0.85 | CTSK (0.42) | CTSKCTSSCTSLCTSB | |
| Trifluoroacetic Acid SCHEMBL5791505 | 0.84 | LMNA (0.40) | CTSKALDH1A1MEN1KMT2ACYP1A2 | |
| Trifluoroacetic Acid SCHEMBL5791881 | 0.83 | CTSK (0.40) | CTSKCTSSCTSLCTSB |
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 2 patents. 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 | claimed |
| WO-2006027211-A1 | 2,4-SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2006-03-16 | — | — | WO | disclosed |