Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
| ▸ | DDB1 | Q16531 | 4/20 | 0.41 |
| ▸ | CRBN | Q96SW2 | 4/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.37 |
| ▸ | PRKCI | P41743 | 1/20 | 0.34 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.32 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10163884 | 0.79 | GAA (0.47) | CHRNB4CHRNA3DDB1CRBNDRD2 | |
| SCHEMBL6437169 | 0.76 | DDB1 (0.46) | DDB1CRBNCTSDALDH1A1 | |
| SCHEMBL4477872 | 0.76 | DDB1 (0.46) | DDB1CRBNCTSDALDH1A1 | |
| SCHEMBL671164 | 0.69 | CHRNB4 (0.40) | CHRNB4CHRNA3DDB1CRBNDRD2 | |
| SCHEMBL22480924 | 0.67 | CA2 (0.60) | CHRNB4CHRNA3DDB1CRBN | |
| SCHEMBL12809720 | 0.67 | HRH3 (0.44) | HRH3 | |
| SCHEMBL16957589 | 0.67 | DRD2 (0.55) | CHRNB4CHRNA3DRD2DRD3PRKCI | |
| SCHEMBL18585843 | 0.66 | CHRNB4 (0.49) | CHRNB4CHRNA3DRD2DRD3PRKCI | |
| SCHEMBL21105884 | 0.66 | TDP1 (0.58) | DDB1CRBN | |
| SCHEMBL16644678 | 0.66 | TDP1 (0.58) | DDB1CRBN |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996027370-A1 | FREE RADICAL SCAVENGER MOLECULES | BRITISH TECHNOLOGY GROUP LIMITED (GB) | 1996-09-12 | — | — | WO | disclosed |