Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.50 |
| ▸ | CA1 | P00915 | 5/20 | 0.48 |
| ▸ | CA2 | P00918 | 5/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.47 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19253399 | 0.82 | PKM (0.45) | PKMCA1CA2CA9CA12 | |
| SCHEMBL10975510 | 0.82 | CA1 (0.47) | PKMCA1CA2CA9CA12 | |
| SCHEMBL11830414 | 0.80 | CA1 (0.46) | PKMCA1CA2CA9CA12 | |
| SCHEMBL7069246 | 0.79 | KDM4E (0.50) | KEAP1NFE2L2CES2CES1KDM4E | |
| SCHEMBL11231453 | 0.77 | CA1 (0.43) | PKMCA1CA2CA9CA12 | |
| SCHEMBL11598690 | 0.77 | MAPT (0.47) | CA1CA2CA9CA12CA7 | |
| 1,4-Dimethoxybenzene SCHEMBL3855313 | 0.77 | PKM (0.58) | PKMCA1CA2CA9CA12 | |
| SCHEMBL11276636 | 0.76 | CA1 (0.65) | PKMCA1CA2CA9CA12 | |
| SCHEMBL11199444 | 0.75 | CA1 (0.44) | PKMCA1CA2CA9CA12 | |
| SCHEMBL8754731 | 0.75 | LMNA (0.48) | PKMCA1CA2CA9CA12 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5596128-A | SULFONATION WITHOUT A CATALYST IN THE PRESENCE OF SOLVENT | KONISHI CHEMICAL IND. CO., LTD. (JP) | 1997-01-21 | — | — | US | disclosed |
| EP-0505582-B1 | SULFONATING AGENT AND PROCESS | KONISHI CHEM IND (JP) | 1996-07-31 | — | — | EP | disclosed |
| EP-0505582-A1 | SULFONATING AGENT AND PROCESS | KONISHI CHEMICAL IND. CO., LTD. (JP) | 1992-09-30 | — | — | EP | disclosed |
| US-3932376-A | DYEING POLYAMIDES | CROMPTON & KNOWLES CORPORATION (US) | 1976-01-13 | — | — | US | disclosed |