Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.52 |
| ▸ | ADAMTS4 | O75173 | 2/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 3/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.43 |
| ▸ | MMP9 | P14780 | 2/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CPA3 | P15088 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 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 | |
|---|---|---|---|---|
| SCHEMBL27642228 | 1.00 | ADAMTS5 (0.52) | ADAMTS5ADAMTS4HSD11B1KEAP1NFE2L2 | |
| SCHEMBL28171647 | 0.88 | ADAMTS5 (0.50) | ADAMTS5ADAMTS4HSD11B1KEAP1NFE2L2 | |
| SCHEMBL27725761 | 0.84 | ADAMTS5 (0.54) | ADAMTS5ADAMTS4HSD11B1KEAP1NFE2L2 | |
| SCHEMBL600070 | 0.84 | ADAMTS5 (0.51) | ADAMTS5ADAMTS4HSD11B1KEAP1NFE2L2 | |
| SCHEMBL14676567 | 0.83 | ADAMTS5 (0.56) | ADAMTS5ADAMTS4HSD11B1KEAP1NFE2L2 | |
| SCHEMBL8446558 | 0.75 | ADAMTS5 (0.44) | ADAMTS5ADAMTS4MMP9MMP8MMP13 | |
| SCHEMBL29793088 | 0.75 | KEAP1 (0.52) | KEAP1NFE2L2CA12CA1CA2 | |
| SCHEMBL28271551 | 0.74 | CPA3 (0.45) | MMP9CPA3FOLH1MAPK1MMP2 | |
| SCHEMBL14798295 | 0.74 | ADAMTS4 (0.58) | ADAMTS5ADAMTS4HSD11B1KEAP1NFE2L2 | |
| SCHEMBL12907960 | 0.74 | ADAMTS4 (0.58) | ADAMTS5ADAMTS4HSD11B1KEAP1NFE2L2 |
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-100341850-C | Salts of demethyl phencynonate isomer and N-para-methyl-phenyl-sulfuryl glutamic acid optical isomer and their preparing method and use | INST OF POISONOUS MEDICINE ACA (CN) | 2007-10-10 | — | — | CN | disclosed |
| CN-1781904-A | Salts of demethyl phencynonate isomer and N-para-methyl-phenyl-sulfuryl glutamic acid optical isomer and their preparing method and use | INST OF POISONOUS MEDICINE ACA (CN) | 2006-06-07 | — | — | CN | disclosed |