Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.46 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA7 | P43166 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | XDH | P47989 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | FUT7 | Q11130 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7373231 | 0.82 | ALDH1A1 (0.46) | ALDH1A1BAZ2BBAZ2ACA12CA1 | |
| SCHEMBL24930955 | 0.76 | ALDH1A1 (0.46) | ALDH1A1BAZ2BBAZ2ACA12CA1 | |
| SCHEMBL10937890 | 0.76 | ALDH1A1 (0.46) | ALDH1A1BAZ2BBAZ2ACA12CA1 | |
| SCHEMBL77311 | 0.75 | NOTUM (0.59) | ALDH1A1BAZ2BBAZ2ACA12CA1 | |
| SCHEMBL70354 | 0.73 | BAZ2B (0.71) | ALDH1A1BAZ2BBAZ2ACA12CA1 | |
| SCHEMBL1156046 | 0.72 | ALDH1A1 (0.46) | ALDH1A1BAZ2BBAZ2ACA12CA1 | |
| SCHEMBL12272617 | 0.72 | ALDH1A1 (0.46) | ALDH1A1BAZ2BBAZ2ACA12CA1 | |
| SCHEMBL28966502 | 0.72 | ALDH1A1 (0.46) | ALDH1A1BAZ2BBAZ2ACA12CA1 | |
| SCHEMBL4538667 | 0.71 | POLB (0.44) | ALDH1A1BAZ2BBAZ2ACA12CA1 | |
| SCHEMBL21802602 | 0.71 | MAP2K1 (0.41) | ALDH1A1POLBKDM4ETDP1LMNA |
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-105693645-A | FUSED HETEROCYCLIC COMPOUNDS AS SODIUM CHANNEL MODULATORS | 吉利德科学公司 | 2016-06-22 | — | — | CN | disclosed |