Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.69 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.69 |
| ▸ | CSNK1D | P48730 | 5/20 | 0.69 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.69 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.69 |
| ▸ | RELA | Q04206 | 2/20 | 0.69 |
| ▸ | POLB | P06746 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.68 |
| ▸ | ACP1 | P24666 | 1/20 | 0.68 |
| ▸ | NCS1 | P62166 | 1/20 | 0.66 |
| ▸ | NPC1 | O15118 | 8/20 | 0.65 |
| ▸ | RAB9A | P51151 | 8/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.64 |
| ▸ | HTT | P42858 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 5/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.64 |
| ▸ | GAA | P10253 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL29485044 | 1.00 | DYRK1A (0.69) | DYRK1AADORA1SMN1; SMN2CSNK1DNFKB1 | |
| SCHEMBL29485043 | 1.00 | DYRK1A (0.69) | DYRK1AADORA1SMN1; SMN2CSNK1DNFKB1 | |
| SCHEMBL32674581 | 0.85 | NPC1 (0.84) | DYRK1AADORA1SMN1; SMN2CSNK1DNFKB1 | |
| SCHEMBL5313704 | 0.84 | CSNK1D (0.69) | DYRK1AADORA1SMN1; SMN2CSNK1DNFKB1 | |
| SCHEMBL7933388 | 0.84 | HDAC3 (0.71) | DYRK1AADORA1SMN1; SMN2CSNK1DNFKB1 | |
| SCHEMBL6206186 | 0.84 | RAB9A (0.72) | DYRK1AADORA1SMN1; SMN2CSNK1DNFKB1 | |
| Ethylene SCHEMBL8167289 | 0.84 | CSNK1D (0.69) | DYRK1AADORA1SMN1; SMN2CSNK1DNFKB1 | |
| SCHEMBL4858014 | 0.84 | CSNK1D (0.69) | DYRK1AADORA1SMN1; SMN2CSNK1DNFKB1 | |
| Hydrochloric Acid SCHEMBL25333657 | 0.83 | CSNK1D (0.68) | DYRK1AADORA1SMN1; SMN2CSNK1DNFKB1 | |
| SCHEMBL3933070 | 0.83 | DYRK1A (0.72) | DYRK1AADORA1SMN1; SMN2CSNK1DNFKB1 |
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-118063452-A | Benzothiazole or benzoxazole derivative and preparation method and application thereof | 山东大学 | 2024-05-24 | — | — | CN | disclosed |