Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.55 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.48 |
| ▸ | CDK2 | P24941 | 2/20 | 0.48 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2570701 | 1.00 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1NPSR1CCNA2CDK2 | |
| SCHEMBL2573328 | 0.81 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1CCNA2CDK2CCNA1 | |
| SCHEMBL2573323 | 0.81 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1CCNA2CDK2CCNA1 | |
| SCHEMBL2561024 | 0.79 | TTK (0.56) | — | |
| SCHEMBL2561018 | 0.79 | TTK (0.56) | — | |
| SCHEMBL2564742 | 0.78 | ALDH1A1 (0.57) | ALDH1A1L3MBTL1NPSR1CCNA2CDK2 | |
| SCHEMBL2564744 | 0.78 | ALDH1A1 (0.57) | ALDH1A1L3MBTL1NPSR1CCNA2CDK2 | |
| SCHEMBL4006011 | 0.71 | ROCK2 (0.56) | ALDH1A1L3MBTL1NPSR1LMNAGAA | |
| SCHEMBL14863488 | 0.71 | TTK (0.47) | ALDH1A1LMNAKDM4E | |
| SCHEMBL4002916 | 0.71 | ROCK2 (0.56) | ALDH1A1L3MBTL1NPSR1LMNAGAA |
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-2011123937-A1 | KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIVERSITY HEALTH NETWORK (CA) | 2011-10-13 | — | — | WO | disclosed |