Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WNT3A | P56704 | 1/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 3/20 | 0.38 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.38 |
| ▸ | CACNA1I | Q9P0X4 | 2/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 3/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.35 |
| ▸ | VNN1 | O95497 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 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 | |
|---|---|---|---|---|
| SCHEMBL5794190 | 0.89 | ALDH1A1 (0.41) | WNT3AMEN1KMT2ASMN1; SMN2CTSK | |
| SCHEMBL5794599 | 0.88 | CTSK (0.38) | CACNA1HNTRK1CTSKCTSLCTSB | |
| SCHEMBL5790864 | 0.87 | HTT (0.39) | WNT3AKMT2ACTSKCTSLCTSB | |
| SCHEMBL5804787 | 0.86 | HPGD (0.41) | WNT3ASMN1; SMN2CTSKCTSLCTSB | |
| Trifluoroacetic Acid SCHEMBL5791900 | 0.85 | CTSK (0.44) | KMT2ASMN1; SMN2CTSKCTSLCTSB | |
| SCHEMBL8270730 | 0.85 | CTSK (0.42) | MEN1KMT2ASMN1; SMN2CTSKCTSL | |
| SCHEMBL8270011 | 0.85 | ALDH1A1 (0.39) | CACNA1HCACNA1GCACNA1IKMT2ACTSK | |
| SCHEMBL5794156 | 0.85 | CTSK (0.40) | KMT2ASMN1; SMN2CTSKCTSLCTSB | |
| Trifluoroacetic Acid SCHEMBL5790897 | 0.85 | CTSK (0.38) | MEN1KMT2ASMN1; SMN2CTSKCTSL | |
| SCHEMBL8271456 | 0.85 | CTSK (0.47) | KMT2ASMN1; SMN2CTSKCTSLCTSB |
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 3 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 |
| WO-2006027211-A1 | 2,4-SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2006-03-16 | — | — | WO | disclosed |