Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CTSK | P43235 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 3/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.34 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5807653 | 0.82 | CTSK (0.35) | CTSKFGFR4 | |
| SCHEMBL5793909 | 0.79 | CTSK (0.41) | CTSKFGFR4GPR119 | |
| SCHEMBL5791458 | 0.78 | KMT2A (0.41) | MEN1KMT2ANPC1RAB9ATP53 | |
| SCHEMBL5794212 | 0.77 | HPGD (0.41) | MEN1KMT2ARAB9ASMN1; SMN2CTSK | |
| SCHEMBL5793159 | 0.75 | CTSK (0.36) | KMT2ANPC1RAB9ASMN1; SMN2CTSK | |
| SCHEMBL5791288 | 0.75 | MAPK14 (0.43) | NPC1RAB9ATSHRCTSKFGFR4 | |
| Trifluoroacetic Acid SCHEMBL5793434 | 0.75 | CTSK (0.44) | MEN1KMT2ACTSKCTSSCTSL | |
| SCHEMBL5791044 | 0.74 | CTSK (0.45) | CTSKCTSSCTSLFGFR4 | |
| Trifluoroacetic Acid SCHEMBL5791892 | 0.72 | CTSK (0.38) | CTSKCTSSFGFR4 | |
| SCHEMBL5792335 | 0.72 | CTSK (0.37) | KMT2ANPC1RAB9ATSHRSMN1; SMN2 |
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 |