Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3867594 | 1.00 | KMT2A (0.59) | KMT2AMAPK1GRM5P2RX3CYP2D6 | |
| SCHEMBL13752129 | 1.00 | KMT2A (0.59) | KMT2AMAPK1GRM5P2RX3CYP2D6 | |
| SCHEMBL15850937 | 0.87 | KMT2A (0.61) | KMT2AMAPK1GRM5P2RX3CYP2D6 | |
| SCHEMBL13752131 | 0.87 | KMT2A (0.61) | KMT2AMAPK1GRM5P2RX3CYP2D6 | |
| SCHEMBL13495538 | 0.87 | KMT2A (0.61) | KMT2AMAPK1GRM5P2RX3CYP2D6 | |
| SCHEMBL3123853 | 0.86 | KMT2A (0.58) | KMT2AMAPK1GRM5P2RX3CYP2D6 | |
| SCHEMBL3123858 | 0.86 | KMT2A (0.58) | KMT2AMAPK1GRM5P2RX3CYP2D6 | |
| SCHEMBL3114229 | 0.86 | KMT2A (0.54) | KMT2AMAPK1GRM5P2RX3CYP2D6 | |
| SCHEMBL3120822 | 0.86 | KMT2A (0.54) | KMT2AMAPK1GRM5P2RX3CYP2D6 | |
| SCHEMBL8312108 | 0.86 | KMT2A (0.54) | KMT2AMAPK1GRM5P2RX3CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009053446-A2 | PREGABALIN INTERMEDIATES AND PROCESS FOR PREPARING THEM AND PREGABALIN | CHEMO IBÉRICA, S.A. (ES) | 2009-04-30 | — | — | WO | disclosed |