Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 9/20 | 0.61 |
| ▸ | HSP90AB1 | P08238 | 9/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.61 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.52 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.41 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | PAK4 | O96013 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | PRKACA | P17612 | 1/20 | 0.41 |
| ▸ | GRK5 | P34947 | 1/20 | 0.41 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.41 |
| ▸ | CDK8 | P49336 | 1/20 | 0.41 |
| ▸ | CLK2 | P49760 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13288406 | 0.85 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1KDM4EPIK3CDHRH4 | |
| SCHEMBL3951575 | 0.79 | HSP90AB1 (0.72) | HSP90AA1HSP90AB1KDM4EHRH4ALDH1A1 | |
| SCHEMBL14413753 | 0.79 | HSP90AA1 (0.72) | HSP90AA1HSP90AB1KDM4EHRH4ALDH1A1 | |
| SCHEMBL13288409 | 0.77 | HSP90AB1 (0.54) | HSP90AA1HSP90AB1KDM4EHRH4ALDH1A1 | |
| SCHEMBL1644353 | 0.76 | HSP90AA1 (0.68) | HSP90AA1HSP90AB1KDM4EHRH4ALDH1A1 | |
| SCHEMBL13288410 | 0.76 | HSP90AA1 (0.68) | HSP90AA1HSP90AB1KDM4EHRH4ALDH1A1 | |
| SCHEMBL3451558 | 0.76 | HSP90AB1 (0.68) | HSP90AA1HSP90AB1KDM4EHRH4ALDH1A1 | |
| SCHEMBL13288405 | 0.76 | HSP90AA1 (0.67) | HSP90AA1HSP90AB1KDM4EHRH4ALDH1A1 | |
| SCHEMBL6984646 | 0.76 | RAB9A (0.59) | KDM4EPIK3CDALDH1A1ADORA2AADORA1 | |
| SCHEMBL1643108 | 0.76 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1KDM4EHRH4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7737153-B2 | Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-06-15 | — | — | US | disclosed |
| US-7737153-B2 | Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-06-15 | — | — | US | disclosed |
| WO-2004039796-A1 | HETEROARYLOXY-SUBSTITUTED PHENYLAMINOPYRIMIDINES AS RHO-KINASE INHIBITORS | BAYER HEALTHCARE AG (DE) | 2004-05-13 | — | — | WO | disclosed |