Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 2/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23937901 | 0.96 | KDM4E (0.41) | KDM4EL3MBTL1SMN1; SMN2HTTALDH1A1 | |
| SCHEMBL13159948 | 0.76 | KDM4E (0.46) | KDM4EL3MBTL1SMN1; SMN2HTTALDH1A1 | |
| SCHEMBL20631145 | 0.74 | LMNA (0.30) | KDM4ELMNA | |
| SCHEMBL20631148 | 0.74 | PTGS2 (0.32) | KDM4E | |
| SCHEMBL19312297 | 0.74 | KDM4E (0.44) | KDM4EL3MBTL1SMN1; SMN2HTTALDH1A1 | |
| SCHEMBL23937897 | 0.72 | PARP1 (0.33) | PARP1 | |
| SCHEMBL14752475 | 0.71 | PARP1 (0.43) | KDM4EL3MBTL1SMN1; SMN2HTTALDH1A1 | |
| SCHEMBL8270929 | 0.71 | HTT (0.62) | KDM4EL3MBTL1SMN1; SMN2HTTALDH1A1 | |
| SCHEMBL20631134 | 0.71 | KDM4E (0.42) | KDM4EL3MBTL1SMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL20631147 | 0.70 | LMNA (0.33) | KMT2AGAAMAPK1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3399968-B1 | SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE | CS PHARMATECH LTD (KY) | 2021-10-20 | — | — | EP | disclosed |