Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 2/20 | 0.48 |
| ▸ | IL1RN | P18510 | 1/20 | 0.48 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PGR | P06401 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.41 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.41 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22163647 | 0.78 | PTGS1 (0.33) | — | |
| SCHEMBL9868435 | 0.77 | L3MBTL1 (0.38) | KMT2AMEN1ALDH1A1CA2CA1 | |
| SCHEMBL9867665 | 0.73 | KEAP1 (0.43) | KEAP1IL1RNERAP1PKMKMT2A | |
| SCHEMBL8164647 | 0.73 | GLO1 (0.55) | KEAP1IL1RNERAP1PKMKMT2A | |
| SCHEMBL7136777 | 0.73 | HTR6 (0.48) | PKMKMT2AMEN1ALDH1A1CA2 | |
| SCHEMBL9866654 | 0.72 | ALDH1A1 (0.38) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL9378913 | 0.72 | KIF18A (0.47) | KMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL9866452 | 0.72 | ALDH1A1 (0.43) | PKMKMT2AALDH1A1PGRCA2 | |
| SCHEMBL9867995 | 0.71 | KMT2A (0.45) | PKMKMT2AALDH1A1MAPT | |
| SCHEMBL9866569 | 0.71 | AR (0.51) | KMT2AMEN1PGRPOLBHTR6 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| EP-0356029-A2 | Insecticidal compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-02-28 | — | — | EP | disclosed |