Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.46 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | CCR6 | P51684 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13621092 | 0.84 | ATM (0.52) | ATML3MBTL1ALDH1A1CYP1A2CHRM3 | |
| SCHEMBL954586 | 0.83 | ATM (0.51) | ATML3MBTL1ALDH1A1CYP1A2CHRM3 | |
| SCHEMBL954588 | 0.83 | ATM (0.51) | ATML3MBTL1ALDH1A1CYP1A2CHRM3 | |
| SCHEMBL14000465 | 0.83 | ATM (0.51) | ATML3MBTL1ALDH1A1CYP1A2CHRM3 | |
| SCHEMBL11735947 | 0.83 | ALDH1A1 (0.40) | ALDH1A1CHRM3OPRM1KCNH2 | |
| SCHEMBL12393383 | 0.83 | ALDH1A1 (0.40) | ALDH1A1CHRM3OPRM1KCNH2 | |
| SCHEMBL11727212 | 0.80 | CHRM3 (0.52) | ATML3MBTL1ALDH1A1CYP1A2CHRM3 | |
| SCHEMBL12393409 | 0.80 | ALDH1A1 (0.44) | ALDH1A1CYP2D6OPRM1KCNH2 | |
| SCHEMBL11834928 | 0.75 | ACKR3 (0.47) | ATML3MBTL1ALDH1A1CYP1A2CHRM3 | |
| SCHEMBL963408 | 0.73 | MEN1 (0.46) | CYP2D6OPRM1SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4002766-A | 1-R-3-PYRROLIDINYL-A,A-DIPHENYLACETAMIDES, -ACETONITRILES, AND -METHANES | A. H. ROBINS COMPANY, INCORPORATED (US) | 1977-01-11 | — | — | US | disclosed |