Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.35 |
| ▸ | PTAFR | P25105 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL28133174 | 0.85 | CES1 (0.43) | CES1SRD5A1SRD5A2CYP2A6MAOA | |
| SCHEMBL8119477 | 0.85 | SRD5A2 (0.49) | CES1SRD5A1SRD5A2CYP2A6MAOA | |
| SCHEMBL6337844 | 0.81 | PTAFR (0.41) | CES1SRD5A1SRD5A2CYP2A6MAOA | |
| SCHEMBL8111658 | 0.81 | NOTUM (0.45) | CES1SRD5A1SRD5A2CYP2A6MAOA | |
| SCHEMBL4527055 | 0.81 | HTR6 (0.35) | CES1SRD5A1SRD5A2MAOAMAOB | |
| SCHEMBL145272 | 0.80 | CES1 (0.39) | CES1SRD5A1SRD5A2CYP2A6MAOA | |
| SCHEMBL5230608 | 0.77 | L3MBTL1 (0.49) | CES1HPGDKDM4EALDH1A1LMNA | |
| SCHEMBL26421241 | 0.77 | SMN1; SMN2 (0.49) | CES1SRD5A1SRD5A2HPGDKDM4E | |
| SCHEMBL2675859 | 0.77 | AKT1 (0.40) | CES1SRD5A1SRD5A2CYP2A6MAOA | |
| SCHEMBL9057287 | 0.75 | MAPT (0.48) | SRD5A1SRD5A2HPGDKDM4EALDH1A1 |
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-1934181-A2 | KINASE INHIBITORS | Devgen NV (BE) | 2008-06-25 | — | — | EP | disclosed |
| WO-2007042321-A2 | KINASE INHIBITORS | DEVGEN N.V. (BE) | 2007-04-19 | — | — | WO | disclosed |