Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 6/20 | 0.67 |
| ▸ | HSP90AB1 | P08238 | 6/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.67 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.58 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.53 |
| ▸ | CDC7 | O00311 | 1/20 | 0.49 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.49 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.49 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.49 |
| ▸ | PAK4 | O96013 | 1/20 | 0.49 |
| ▸ | PIM1 | P11309 | 1/20 | 0.49 |
| ▸ | PRKACA | P17612 | 1/20 | 0.49 |
| ▸ | GRK5 | P34947 | 1/20 | 0.49 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.49 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.49 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.49 |
| ▸ | CDK8 | P49336 | 1/20 | 0.49 |
| ▸ | CLK2 | P49760 | 1/20 | 0.49 |
| ▸ | GSK3A | P49840 | 1/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL21058625 | 0.83 | CYP19A1 (0.56) | HSP90AA1HSP90AB1KDM4EPTK2CYP19A1 | |
| SCHEMBL19053846 | 0.83 | ADORA2A (0.71) | HSP90AA1HSP90AB1KDM4EPTK2CYP19A1 | |
| SCHEMBL15757779 | 0.83 | HSP90AA1 (0.62) | HSP90AA1HSP90AB1KDM4EPTK2CYP19A1 | |
| SCHEMBL30488026 | 0.83 | HSP90AA1 (0.62) | HSP90AA1HSP90AB1KDM4EPTK2CYP19A1 | |
| SCHEMBL1643108 | 0.80 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1KDM4EPRKACAHRH4 | |
| SCHEMBL3951935 | 0.80 | HSP90AA1 (0.58) | HSP90AA1HSP90AB1KDM4EPTK2CYP19A1 | |
| SCHEMBL717689 | 0.79 | HSP90AA1 (0.70) | HSP90AA1HSP90AB1KDM4ECDC7DAPK3 | |
| SCHEMBL31191947 | 0.77 | CYP19A1 (0.67) | HSP90AA1HSP90AB1KDM4EPTK2CYP19A1 | |
| SCHEMBL18646838 | 0.77 | CYP19A1 (0.61) | HSP90AA1HSP90AB1KDM4EPTK2CYP19A1 | |
| SCHEMBL20400178 | 0.76 | HSP90AA1 (0.54) | HSP90AA1HSP90AB1KDM4EPTK2CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |