Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.33 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.33 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7029292 | 0.94 | TDP1 (0.35) | TDP1ALDH1A1CYP2C9CYP1A2CYP2A6 | |
| SCHEMBL16105750 | 0.78 | TDP1 (0.44) | TDP1ALDH1A1CYP2C9CYP1A2CYP2A6 | |
| SCHEMBL3166363 | 0.78 | ALDH1A1 (0.48) | TDP1ALDH1A1CYP2C9CYP1A2CYP2A6 | |
| SCHEMBL5300761 | 0.74 | ALDH1A1 (0.46) | TDP1ALDH1A1CYP2C9CYP1A2CYP2A6 | |
| SCHEMBL9115636 | 0.74 | SMN1; SMN2 (0.42) | TDP1ALDH1A1CYP2C9CYP1A2CYP2A6 | |
| SCHEMBL23211226 | 0.74 | ALDH1A1 (0.46) | TDP1ALDH1A1CYP2C9CYP1A2CYP2A6 | |
| SCHEMBL23029423 | 0.74 | SMN1; SMN2 (0.42) | TDP1ALDH1A1CYP2C9CYP1A2CYP2A6 | |
| SCHEMBL10328480 | 0.74 | SMN1; SMN2 (0.42) | TDP1ALDH1A1CYP2C9CYP1A2CYP2A6 | |
| SCHEMBL26745521 | 0.74 | TDP1 (0.41) | TDP1ALDH1A1CYP2C9CYP1A2CYP2A6 | |
| SCHEMBL15200202 | 0.74 | ALDH1A1 (0.41) | TDP1ALDH1A1CYP2C9CYP1A2CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111742008-A | Polyolefin and polyvinylpyrrolidone formulations | 陶氏环球技术有限责任公司 | 2020-10-02 | — | — | CN | disclosed |