Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.36 |
| ▸ | AURKA | O14965 | 2/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | MARK3 | P27448 | 1/20 | 0.36 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.36 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | MARK2 | Q7KZI7 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13866833 | 0.70 | — | — | |
| SCHEMBL13866825 | 0.69 | CYP1A2 (0.35) | CYP1A2CYP2D6MAPK1CHEK1AURKA | |
| SCHEMBL8856393 | 0.58 | CHEK1 (0.47) | CYP1A2CYP2D6MAPK1CHEK1AURKA | |
| SCHEMBL9604572 | 0.56 | CYP1A2 (0.69) | CYP1A2CYP2D6MAPK1 | |
| SCHEMBL13828285 | 0.55 | SMN1; SMN2 (0.68) | CYP1A2CYP2D6MAPK1CHEK1AURKA | |
| SCHEMBL11987584 | 0.55 | ALDH1A1 (0.32) | ALDH1A1TSHR | |
| SCHEMBL18961772 | 0.55 | ALOX15 (0.39) | CYP1A2CYP2D6MAPK1CHEK1AURKA | |
| SCHEMBL2316376 | 0.54 | CHEK1 (0.42) | CYP1A2CYP2D6MAPK1CHEK1AURKA | |
| SCHEMBL13866828 | 0.54 | CYP1A2 (0.44) | CYP1A2CYP2D6MAPK1KDM4EALDH1A1 | |
| Dimethyladenine SCHEMBL152594 | 0.53 | LRRK2 (1.00) | CHEK1AURKAPDPK1CHEK2HSP90AA1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7524847-B2 | Fused 1,3-dihydro-imidazole ring compounds | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2009-04-28 | — | — | US | disclosed |