Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9866318 | 0.81 | ALDH1A1 (0.36) | SMN1; SMN2ALDH1A1HTT | |
| SCHEMBL9867057 | 0.78 | ALDH1A1 (0.35) | SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL9866681 | 0.77 | KAT8 (0.47) | MAPK8ALDH1A1 | |
| SCHEMBL9867665 | 0.77 | KEAP1 (0.43) | PKMALDH1A1POLB | |
| SCHEMBL9867726 | 0.75 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL245099 | 0.75 | DHFR (0.41) | SMN1; SMN2DHFRTSHRTDP1PKM | |
| SCHEMBL9865854 | 0.75 | HCAR1 (0.39) | SMN1; SMN2 | |
| SCHEMBL9865677 | 0.74 | HCAR1 (0.36) | — | |
| SCHEMBL9866908 | 0.74 | ALDH1A1 (0.39) | SMN1; SMN2PKMALDH1A1HTTPOLB | |
| SCHEMBL10374251 | 0.73 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1HTTKDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-4987141-A | DERIVATIVES OF BENZENE OR PYRIDINE HAVING SULFONATE AND SULFENYL, SULFONIMIDE OR SULFONAMIDE GROUPS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-01-22 | — | — | US | disclosed |
| CN-1042144-A | Pesticidal compound | ICI PLC (GB) | 1990-05-16 | — | — | CN | disclosed |
| EP-0356029-A2 | Insecticidal compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-02-28 | — | — | EP | disclosed |