Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 5/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 4/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.35 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.35 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL977680 | 0.80 | MAPK14 (0.47) | HPGDKDM4EALDH1A1SMN1; SMN2PARP10 | |
| SCHEMBL976155 | 0.77 | MAPK14 (0.47) | HPGDKDM4EALDH1A1SMN1; SMN2PARP10 | |
| SCHEMBL975773 | 0.77 | CYP1A2 (0.47) | HPGDKDM4EALDH1A1SMN1; SMN2PARP10 | |
| SCHEMBL977196 | 0.77 | CYP3A4 (0.44) | HPGDKDM4EALDH1A1SMN1; SMN2PARP10 | |
| SCHEMBL978001 | 0.76 | MEN1 (0.45) | HPGDKDM4EALDH1A1SMN1; SMN2PARP10 | |
| SCHEMBL975660 | 0.76 | KDM4E (0.46) | HPGDKDM4EALDH1A1SMN1; SMN2PARP10 | |
| SCHEMBL977752 | 0.75 | PARP10 (0.50) | HPGDKDM4EALDH1A1SMN1; SMN2PARP10 | |
| SCHEMBL977769 | 0.74 | NPC1 (0.43) | HPGDKDM4EALDH1A1SMN1; SMN2PARP10 | |
| SCHEMBL976551 | 0.74 | PARP10 (0.56) | HPGDKDM4EALDH1A1SMN1; SMN2PARP10 | |
| SCHEMBL977374 | 0.73 | MAPT (0.43) | KDM4EALDH1A1SMN1; SMN2PARP10SYK |
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-2209761-A1 | DIPHENYL SUBSTITUTED CYCLOALKANES | Merck Sharp & Dohme Corp. (US) | 2010-07-28 | — | — | EP | disclosed |
| WO-2009048547-A1 | DIPHENYL SUBSTITUTED CYCLOALKANES | MERCK & CO., INC. (US) | 2009-04-16 | — | — | WO | disclosed |