Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 2/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| O-Xylene SCHEMBL11490623 | 0.86 | TSHR (0.48) | KEAP1NFE2L2TSHRACHEKMT2A | |
| Benzene SCHEMBL11855931 | 0.83 | NAAA (0.39) | MEN1KMT2ANPSR1GABRA1GABRB2 | |
| Benzene SCHEMBL28876662 | 0.83 | NAAA (0.39) | MEN1KMT2ANPSR1GABRA1GABRB2 | |
| SCHEMBL9919 | 0.81 | — | — | |
| O-Xylene SCHEMBL27972484 | 0.81 | TSHR (0.39) | KEAP1NFE2L2TSHRACHEP2RX7 | |
| Toluene SCHEMBL28100339 | 0.80 | LMNA (0.38) | KEAP1NFE2L2TSHRACHENAAA | |
| SCHEMBL11419613 | 0.80 | MIF (0.56) | NAAAMIFCNR2 | |
| Benzoic Acid SCHEMBL1793582 | 0.79 | TSHR (0.47) | TSHRALDH1A1TP53NAAA | |
| Hydrochloric Acid SCHEMBL8196526 | 0.79 | — | — | |
| Fluoride SCHEMBL28174258 | 0.79 | — | — |
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-112552214-A | Production process for improving quality of sulfonyl isocyanate | 安徽广信农化股份有限公司 | 2021-03-26 | — | — | CN | claimed |
| CN-112552214-A | Production process for improving quality of sulfonyl isocyanate | 安徽广信农化股份有限公司 | 2021-03-26 | — | — | CN | disclosed |