Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL8686077 | 0.71 | THRB (0.31) | — | |
| SCHEMBL9250976 | 0.64 | — | — | |
| SCHEMBL132463 | 0.63 | — | — | |
| Trifluoroacetic Acid SCHEMBL4345243 | 0.63 | CES1 (0.48) | ALDH1A1TP53TSHRCYP1A2 | |
| SCHEMBL1225802 | 0.63 | — | — | |
| Trichloroacetic Acid SCHEMBL10704440 | 0.63 | ALDH1A1 (0.83) | ALDH1A1TP53TSHRCYP1A2 | |
| SCHEMBL11356109 | 0.60 | — | — | |
| SCHEMBL11855508 | 0.60 | — | — | |
| SCHEMBL1473621 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL2831514 | 0.60 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110240560-A | A kind of preparation method of the chloro- 2- pyrrole fluoroacetic acid derivative of 3,5- bis- | 浙江省诸暨合力化学对外贸易有限公司 | 2019-09-17 | — | — | CN | claimed |
| CN-110240560-A | A kind of preparation method of the chloro- 2- pyrrole fluoroacetic acid derivative of 3,5- bis- | 浙江省诸暨合力化学对外贸易有限公司 | 2019-09-17 | — | — | CN | disclosed |
| CN-110240560-A | A kind of preparation method of the chloro- 2- pyrrole fluoroacetic acid derivative of 3,5- bis- | 浙江省诸暨合力化学对外贸易有限公司 | 2019-09-17 | — | — | CN | disclosed |
| CN-110240560-A | A kind of preparation method of the chloro- 2- pyrrole fluoroacetic acid derivative of 3,5- bis- | 浙江省诸暨合力化学对外贸易有限公司 | 2019-09-17 | — | — | CN | disclosed |