Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL14186694 | 1.00 | ALDH1A1 (0.46) | ALDH1A1CHRNB2CHRNB4CHRNA4HTT | |
| SCHEMBL5034498 | 0.85 | LMNA (0.50) | ALDH1A1CA1CA2LMNA | |
| SCHEMBL14186203 | 0.85 | LMNA (0.50) | ALDH1A1CA1CA2LMNA | |
| SCHEMBL5038748 | 0.84 | CA1 (0.35) | CA1CA2 | |
| SCHEMBL10521386 | 0.81 | AKR1B1 (0.39) | ALDH1A1 | |
| SCHEMBL2704035 | 0.81 | AKR1B1 (0.39) | ALDH1A1 | |
| SCHEMBL2704033 | 0.81 | AKR1B1 (0.39) | ALDH1A1 | |
| SCHEMBL14367747 | 0.81 | PAOX (0.38) | ALDH1A1CA1CA2 | |
| SCHEMBL5037810 | 0.79 | CYP1A2 (0.49) | ALDH1A1 | |
| SCHEMBL4940078 | 0.79 | CYP1A2 (0.49) | ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1339669-B1 | N-ALKYLATED GABA COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | UCB PHARMA SA (BE) | 2008-06-04 | — | — | EP | disclosed |
| US-7112612-B2 | N-alkylated GABA compounds, processes for their preparation and their use as medicaments | UCB S.A. (BE) | 2006-09-26 | — | — | US | disclosed |