Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.45 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | S100A4 | P26447 | 2/20 | 0.40 |
| ▸ | PTPRC | P08575 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16797211 | 0.83 | TDP1 (0.47) | TDP1GPR35TSHRALDH1A1CYP1A2 | |
| SCHEMBL29509474 | 0.83 | TDP1 (0.47) | TDP1GPR35TSHRALDH1A1CYP1A2 | |
| SCHEMBL16119496 | 0.81 | CYP1A2 (0.47) | TDP1GPR35TSHRALDH1A1CYP1A2 | |
| SCHEMBL9004049 | 0.81 | TDP1 (0.48) | TDP1GPR35TSHRALDH1A1CYP1A2 | |
| SCHEMBL31207336 | 0.80 | CYP1A2 (0.53) | TDP1GPR35TSHRALDH1A1CYP1A2 | |
| SCHEMBL7616610 | 0.80 | CYP1A2 (0.53) | TDP1GPR35TSHRALDH1A1CYP1A2 | |
| SCHEMBL3010961 | 0.80 | TDP1 (0.61) | TDP1GPR35TSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL7858061 | 0.79 | TDP1 (0.46) | TDP1GPR35TSHRALDH1A1CYP1A2 | |
| SCHEMBL16951733 | 0.79 | TDP1 (0.46) | TDP1GPR35TSHRALDH1A1CYP1A2 | |
| SCHEMBL27841207 | 0.79 | TDP1 (0.46) | TDP1GPR35TSHRALDH1A1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115322102-A | Synthetic method for producing 2-fluoro-3-nitrobenzoic acid from 2-chloro-3-nitrotoluene | 老河口华辰化学有限公司 | 2022-11-11 | — | — | CN | claimed |
| CN-115322102-A | Synthetic method for producing 2-fluoro-3-nitrobenzoic acid from 2-chloro-3-nitrotoluene | 老河口华辰化学有限公司 | 2022-11-11 | — | — | CN | disclosed |