Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.56 |
| ▸ | HPN | P05981 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | VCAM1 | P19320 | 11/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL8823327 | 1.00 | ALOX15 (0.56) | ALOX15HPNMAPTSIRT5CA2 | |
| SCHEMBL11563339 | 0.84 | MAPT (0.53) | ALOX15HPNMAPTSIRT5CA2 | |
| SCHEMBL10506075 | 0.81 | ALOX15 (0.50) | ALOX15HPNMAPTSIRT5CA2 | |
| SCHEMBL10698130 | 0.81 | ALOX15 (0.63) | ALOX15HPNMAPTSIRT5CA2 | |
| SCHEMBL646923 | 0.80 | ALOX15 (0.61) | ALOX15HPNMAPTSIRT5CA2 | |
| SCHEMBL9504462 | 0.80 | ALOX15 (0.61) | ALOX15HPNMAPTSIRT5CA2 | |
| SCHEMBL10504211 | 0.79 | MAPT (0.47) | ALOX15HPNMAPTSIRT5CA2 | |
| SCHEMBL9330356 | 0.79 | HPN (0.47) | ALOX15HPNMAPTSIRT5CA2 | |
| SCHEMBL10504900 | 0.78 | ALOX15 (0.46) | ALOX15HPNMAPTSIRT5CA2 | |
| SCHEMBL10503818 | 0.77 | ALOX15 (0.63) | ALOX15HPNMAPTSIRT5CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0492350-B1 | Process for the production of (S)-vinyl and (S) allenyl gaba | MERRELL PHARMA INC (US) | 1997-10-15 | — | — | EP | disclosed |
| US-5208345-A | Substituted Pyrrolidinone Derivatives as Intermediates Optical Isomers | MERRELL DOW PHARMACEUTICALS INC. (US) | 1993-05-04 | — | — | US | disclosed |
| EP-0492350-A1 | Process for the production of (S)-vinyl and (S) allenyl gaba | MERRELL PHARMACEUTICALS INC. (US) | 1992-07-01 | — | — | EP | disclosed |