Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4950183 | 0.74 | — | — | |
| SCHEMBL12067933 | 0.71 | ALDH1A1 (0.42) | — | |
| SCHEMBL689805 | 0.71 | ALDH1A1 (0.42) | — | |
| SCHEMBL4699959 | 0.69 | — | — | |
| SCHEMBL1696277 | 0.69 | — | — | |
| SCHEMBL28296420 | 0.69 | ALOX5 (0.41) | ALOX5CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL6621767 | 0.69 | — | — | |
| SCHEMBL15974149 | 0.69 | ALOX5 (0.45) | ALOX5CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL1992668 | 0.69 | ALOX5 (0.41) | ALOX5CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL13455948 | 0.68 | ALOX5 (0.44) | ALOX5CHRNB2CHRNB4CHRNA3CHRNA4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2326623-B1 | BETA-AND GAMMA-AMINO-ISOQUINOLINE AMIDE COMPOUNDS AND SUBSTITUTED BENZAMIDE COMPOUNDS | AERIE PHARMACEUTICALS INC (US) | 2014-04-16 | — | — | EP | disclosed |