Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA4 | P22748 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 5/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 5/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 5/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 5/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 5/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL25244244 | 0.89 | TDP1 (0.39) | ATMTDP1ALDH1A1TSHRHIF1A | |
| SCHEMBL3823580 | 0.86 | MAPT (0.36) | ATMTDP1ALDH1A1TSHRHIF1A | |
| SCHEMBL17219535 | 0.86 | MAPT (0.36) | ATMTDP1ALDH1A1TSHRHIF1A | |
| SCHEMBL1994831 | 0.84 | TDP1 (0.41) | ATMTDP1ALDH1A1TSHRCA1 | |
| SCHEMBL3808302 | 0.83 | ATM (0.35) | ATMTDP1ALDH1A1TSHRHIF1A | |
| SCHEMBL18298070 | 0.82 | MAPT (0.34) | ATMTDP1ALDH1A1TSHRHIF1A | |
| SCHEMBL17219320 | 0.82 | ALDH1A1 (0.44) | ATMTDP1ALDH1A1TSHRHIF1A | |
| SCHEMBL29344242 | 0.80 | GRIN2D (0.37) | TDP1ALDH1A1HIF1AGRIN2DGRIN3B | |
| SCHEMBL26981516 | 0.80 | GRIN2D (0.49) | ATMTDP1ALDH1A1TSHRHIF1A | |
| SCHEMBL6141212 | 0.79 | MAPT (0.37) | ATMTDP1ALDH1A1TSHRHIF1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105646199-B | The preparation technology of the trifluoro-benzoic acid of 3 chlorine 2,4,5 | 连云港威远精细化工有限公司 | 2017-10-03 | — | — | CN | claimed |
| CN-105646199-B | The preparation technology of the trifluoro-benzoic acid of 3 chlorine 2,4,5 | 连云港威远精细化工有限公司 | 2017-10-03 | — | — | CN | disclosed |
| CN-105646199-A | Preparation process of 3-chloro-2,4,5-trifluorobenzoic acid | 连云港威远精细化工有限公司 | 2016-06-08 | — | — | CN | disclosed |