Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | TSHR | P16473 | 2/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Trichloroacetic Acid SCHEMBL1331160 | 0.82 | — | — | |
| Trichloroacetic Acid SCHEMBL10493657 | 0.82 | TSHR (1.00) | ALDH1A1TSHRTP53CYP1A2 | |
| Trichloroacetic Acid SCHEMBL38661501 | 0.82 | — | — | |
| Trichloroacetic Acid SCHEMBL10745837 | 0.82 | — | — | |
| Trichloroacetic Acid SCHEMBL1331955 | 0.82 | — | — | |
| Trichloroacetic Acid SCHEMBL3220 | 0.82 | — | — | |
| Trichloroacetic Acid SCHEMBL5311061 | 0.82 | TSHR (1.00) | ALDH1A1TSHRTP53CYP1A2 | |
| Trichloroacetic Acid SCHEMBL19810502 | 0.78 | TSHR (0.91) | ALDH1A1TSHRTP53CYP1A2 | |
| Trichloroacetic Acid SCHEMBL108357 | 0.78 | — | — | |
| Trichloroacetic Acid SCHEMBL6553612 | 0.78 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116514894-A | Betulinic acid derivative containing electrophilic warhead, preparation method and application thereof | 大连理工大学 | 2023-08-01 | — | — | CN | claimed |
| CN-105646757-B | A kind of preparation method of cationic polymerization system and high degree of unsaturation isoolefin copolymers | 中国石油化工股份有限公司 | 2018-04-13 | — | — | CN | claimed |
| CN-105646757-A | Cationic polymerization system and preparation method of high-unsaturation-degree isoolefin copolymer | 中国石油化工股份有限公司 | 2016-06-08 | — | — | CN | claimed |
| CN-116514894-B | Betulinic acid derivative containing electrophilic warhead, preparation method and application thereof | 大连理工大学 | 2024-10-01 | — | — | CN | disclosed |
| CN-116514894-A | Betulinic acid derivative containing electrophilic warhead, preparation method and application thereof | 大连理工大学 | 2023-08-01 | — | — | CN | disclosed |
| CN-105646757-B | A kind of preparation method of cationic polymerization system and high degree of unsaturation isoolefin copolymers | 中国石油化工股份有限公司 | 2018-04-13 | — | — | CN | disclosed |
| CN-105646757-A | Cationic polymerization system and preparation method of high-unsaturation-degree isoolefin copolymer | 中国石油化工股份有限公司 | 2016-06-08 | — | — | CN | disclosed |