Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNA2 | P20248 | 7/20 | 0.41 |
| ▸ | CDK2 | P24941 | 7/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | BCL2 | P10415 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | KDM5A | P29375 | 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 | |
|---|---|---|---|---|
| SCHEMBL6771169 | 0.86 | CCNA2 (0.40) | CCNA2CDK2CYP2C9CYP2C19LMNA | |
| SCHEMBL6770744 | 0.86 | CYP2C9 (0.38) | CCNA2CDK2CYP2C9CYP2C19LMNA | |
| SCHEMBL6766539 | 0.85 | CCNA2 (0.35) | CCNA2CDK2CYP2C9CYP2C19LMNA | |
| SCHEMBL6772430 | 0.84 | CCNA2 (0.44) | CCNA2CDK2CYP2C9CYP2C19LMNA | |
| SCHEMBL6771265 | 0.80 | CCNA2 (0.40) | CCNA2CDK2CYP2C9CYP2C19LMNA | |
| SCHEMBL6771267 | 0.80 | CCNA2 (0.40) | CCNA2CDK2CYP2C9CYP2C19LMNA | |
| SCHEMBL6775773 | 0.79 | CCNA2 (0.39) | CCNA2CDK2CYP2C9CYP2C19LMNA | |
| SCHEMBL6770739 | 0.78 | CCNA2 (0.45) | CCNA2CDK2CYP2C9CYP2C19LMNA | |
| SCHEMBL6776854 | 0.77 | PTGS1 (0.42) | CCNA2CDK2CYP2C9CYP2C19LMNA | |
| SCHEMBL6164128 | 0.77 | MEN1 (0.39) | CCNA2CDK2CYP2C9CYP2C19LMNA |
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-6716856-B1 | CELL PROLIFERATIVE DISORDERS OR ALZHEIMER'S DISEASE; REDUCED TOXICITY; CDK/CYCLIN KINASE INHIBITORY ACTIVITY | PHARMACIA & TUBJOHN SPA (IT) | 2004-04-06 | — | — | US | disclosed |