Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.39 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.36 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.36 |
| ▸ | ITGAL | P20701 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 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 | |
|---|---|---|---|---|
| SCHEMBL5924504 | 0.86 | KDM4E (0.42) | FLT3KDM4EMAP2K1ALDH1A1GSK3A | |
| SCHEMBL5924495 | 0.84 | MAP2K1 (0.43) | CDK2FLT3KDM4EMAPK10HSD17B10 | |
| SCHEMBL17321390 | 0.83 | SMN1; SMN2 (0.41) | CCNA2CDK2FLT3CCNA1KDM4E | |
| SCHEMBL29623160 | 0.82 | KDM4E (0.47) | CCNA2CDK2FLT3CCNA1CAMKK2 | |
| SCHEMBL1048847 | 0.82 | KDM4E (0.47) | CCNA2CDK2FLT3CCNA1CAMKK2 | |
| SCHEMBL28098788 | 0.80 | MAP2K1 (0.41) | CCNA2CDK2FLT3CCNA1CAMKK2 | |
| SCHEMBL5924436 | 0.78 | MAP2K1 (0.43) | CAMKK2KDM4EMAPK10HSD17B10MAP2K1 | |
| SCHEMBL29732854 | 0.78 | CAMKK2 (0.46) | CAMKK2KDM4EMAPK10HSD17B10MAP2K1 | |
| SCHEMBL5924295 | 0.78 | KDM4E (0.40) | CCNA2CDK2FLT3CCNA1CAMKK2 | |
| SCHEMBL1384475 | 0.78 | CAMKK2 (0.46) | CAMKK2KDM4EMAPK10HSD17B10MAP2K1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1814883-A1 | BICYCLIC INHIBITORS OR RHO KINASE | Vertex Pharmaceuticals Incorporated (US) | 2007-08-08 | — | — | EP | disclosed |
| WO-2006058120-A1 | BICYCLIC INHIBITORS OR RHO KINASE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-06-01 | — | — | WO | disclosed |