Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ACE | P12821 | 1/20 | 0.40 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3866850 | 1.00 | KMT2A (0.46) | KMT2AALDH1A1HPGDMAPK1HSD11B1 | |
| SCHEMBL14177706 | 0.90 | KMT2A (0.45) | KMT2AALDH1A1HPGDMAPK1HSD11B1 | |
| SCHEMBL14177705 | 0.90 | KMT2A (0.45) | KMT2AALDH1A1HPGDMAPK1HSD11B1 | |
| SCHEMBL14177703 | 0.90 | KMT2A (0.45) | KMT2AALDH1A1HPGDMAPK1HSD11B1 | |
| SCHEMBL14177704 | 0.90 | KMT2A (0.45) | KMT2AALDH1A1HPGDMAPK1HSD11B1 | |
| SCHEMBL14177726 | 0.86 | KMT2A (0.42) | KMT2AALDH1A1HPGDMAPK1HSD11B1 | |
| SCHEMBL14177727 | 0.86 | KMT2A (0.42) | KMT2AALDH1A1HPGDMAPK1HSD11B1 | |
| SCHEMBL14177717 | 0.86 | KMT2A (0.42) | KMT2AALDH1A1HPGDMAPK1HSD11B1 | |
| SCHEMBL14177709 | 0.86 | KMT2A (0.42) | KMT2AALDH1A1HPGDMAPK1HSD11B1 | |
| SCHEMBL14177711 | 0.86 | KMT2A (0.42) | KMT2AALDH1A1HPGDMAPK1HSD11B1 |
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-2053040-A1 | Pregabalin intermediates and process for preparing them and Pregabalin | Chemo Ibérica, S.A. (ES) | 2009-04-29 | — | — | EP | claimed |
| EP-2053040-A1 | Pregabalin intermediates and process for preparing them and Pregabalin | Chemo Ibérica, S.A. (ES) | 2009-04-29 | — | — | EP | disclosed |