Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE1 | P24864 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | CETP | P11597 | 3/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10534606 | 1.00 | CCNE1 (0.39) | CCNE1CDK2PDCD1CD274CETP | |
| SCHEMBL10534817 | 1.00 | CCNE1 (0.39) | CCNE1CDK2PDCD1CD274CETP | |
| SCHEMBL10534608 | 1.00 | CCNE1 (0.39) | CCNE1CDK2PDCD1CD274CETP | |
| SCHEMBL10536324 | 1.00 | CCNE1 (0.39) | CCNE1CDK2PDCD1CD274CETP | |
| SCHEMBL10532760 | 1.00 | CCNE1 (0.39) | CCNE1CDK2PDCD1CD274CETP | |
| SCHEMBL10533400 | 0.99 | CCNE1 (0.40) | CCNE1CDK2PDCD1CD274CETP | |
| SCHEMBL10534089 | 0.88 | MAPT (0.46) | CCNE1CDK2PDCD1CD274MAPT | |
| SCHEMBL10532765 | 0.88 | MAPT (0.46) | CCNE1CDK2PDCD1CD274MAPT | |
| SCHEMBL10532847 | 0.88 | MAPT (0.46) | CCNE1CDK2PDCD1CD274MAPT | |
| SCHEMBL10533486 | 0.88 | MAPT (0.46) | CCNE1CDK2PDCD1CD274MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-1989003416-A1 | FERROELECTRIC LIQUID CRYSTALLINE PHASES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1989-04-20 | — | — | WO | disclosed |