Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL8975926 | 0.83 | CHRNB2 (0.32) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL8976648 | 0.76 | KISS1R (0.32) | — | |
| SCHEMBL7508980 | 0.71 | CHRNB2 (0.36) | TDP1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| Hydrochloric Acid SCHEMBL21197508 | 0.70 | CHRNB2 (0.35) | TDP1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL3091594 | 0.67 | NOS2 (0.40) | TDP1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL7507900 | 0.67 | CHRNB2 (0.32) | TDP1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL4603896 | 0.67 | NOS2 (0.40) | TDP1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL56569 | 0.66 | — | — | |
| SCHEMBL22828000 | 0.66 | — | — | |
| SCHEMBL8976008 | 0.66 | CHRNB2 (0.35) | TDP1CHRNB2CHRNB4CHRNA3CHRNA4 |
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-0514282-B1 | Alkylamino mercaptoalkylamides or salts thereof acceptable for cosmetic use, their use as a reducing agent and a process for the permanent deformation of hair | OREAL (FR) | 1996-04-10 | — | — | EP | claimed |