Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 3/20 | 0.44 |
| ▸ | CTSS | P25774 | 6/20 | 0.35 |
| ▸ | CTSL | P07711 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CTSB | P07858 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | RPS27 | P42677 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.33 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.33 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CCND1 | P24385 | 1/20 | 0.32 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CDK7 | P50613 | 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 | |
|---|---|---|---|---|
| SCHEMBL8271456 | 0.94 | CTSK (0.47) | CTSKCTSSCTSLALDH1A1CTSB | |
| Trifluoroacetic Acid SCHEMBL5790897 | 0.92 | CTSK (0.38) | CTSKCTSSCTSLALDH1A1CTSB | |
| Trifluoroacetic Acid SCHEMBL5794677 | 0.91 | CTSK (0.39) | CTSKCTSSCTSLCTSBKMT2A | |
| Trifluoroacetic Acid SCHEMBL5793822 | 0.89 | MAPK8 (0.35) | CTSKCTSSCTSLCTSBMAPK8 | |
| Trifluoroacetic Acid SCHEMBL5791925 | 0.89 | CTSK (0.38) | CTSKCTSSCTSLCTSBKMT2A | |
| SCHEMBL5791270 | 0.89 | KMT2A (0.41) | CTSKCTSSCTSLALDH1A1CTSB | |
| Trifluoroacetic Acid SCHEMBL5808820 | 0.88 | CTSK (0.37) | CTSKCTSSMAPK8MAPK9LNPEP | |
| SCHEMBL5794599 | 0.88 | CTSK (0.38) | CTSKCTSSCTSLCTSBMAPK8 | |
| Trifluoroacetic Acid SCHEMBL5792655 | 0.88 | MAPT (0.37) | CTSKALDH1A1KMT2ASMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL5792604 | 0.87 | CTSK (0.43) | CTSKCTSSCTSLALDH1A1CTSB |
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 | claimed |