Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | PYGL | P06737 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MRGPRX1 | Q96LB2 | 6/20 | 0.42 |
| ▸ | TLR4 | O00206 | 3/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.39 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.39 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21550169 | 0.92 | KMT2A (0.44) | KMT2APYGLHPGDMRGPRX1TLR4 | |
| SCHEMBL20157979 | 0.79 | MAPT (0.43) | KMT2AHPGDMRGPRX1KDM4EALDH1A1 | |
| SCHEMBL28469744 | 0.77 | NPC1 (0.39) | KMT2APYGLHPGDTLR4MAPK13 | |
| SCHEMBL21550096 | 0.77 | ALDH1A1 (0.44) | PYGLHPGDMAPK13MAPK12MAPK11 | |
| SCHEMBL21564888 | 0.77 | HPGD (0.44) | PYGLHPGDMAPK13MAPK12MAPK11 | |
| SCHEMBL21550148 | 0.76 | PYGL (0.41) | PYGLHPGDMAPK13MAPK12MAPK11 | |
| SCHEMBL21564976 | 0.75 | KCNQ4 (0.39) | PYGLHPGDMAPK13MAPK12MAPK11 | |
| SCHEMBL20157667 | 0.75 | MAPT (0.43) | KMT2AHPGDMRGPRX1KDM4EALDH1A1 | |
| SCHEMBL28465102 | 0.75 | MAPK13 (0.44) | PYGLHPGDMAPK13MAPK12MAPK11 | |
| SCHEMBL21549994 | 0.74 | HPGD (0.37) | KMT2APYGLHPGDMAPK13MAPK12 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111819181-A | Benzo-seven-membered heterocyclic compound, preparation method, pharmaceutical composition and application thereof | 罗欣药业(上海)有限公司 | 2020-10-23 | — | — | CN | disclosed |