Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 3/20 | 0.51 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28650527 | 0.80 | HSD11B1 (0.54) | HSD11B1CYP2C19MEN1KMT2A | |
| SCHEMBL28649696 | 0.80 | HSD11B1 (0.54) | HSD11B1CYP2C19MEN1KMT2A | |
| SCHEMBL28353609 | 0.78 | CHRM2 (0.36) | HSD11B1TRPC5CHRM2CHRM4CHRM5 | |
| SCHEMBL4523411 | 0.78 | CYP2D6 (0.50) | HSD11B1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL3285780 | 0.78 | CYP2D6 (0.50) | HSD11B1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL2132365 | 0.78 | CYP2D6 (0.50) | HSD11B1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL27834508 | 0.77 | NPSR1 (0.44) | HSD11B1TRPC5HPGD | |
| SCHEMBL27834509 | 0.74 | HCRTR1 (0.49) | CYP3A4CYP2C19LMNAMEN1KMT2A | |
| SCHEMBL27834512 | 0.74 | L3MBTL1 (0.46) | LMNAMEN1KMT2AHPGD | |
| SCHEMBL19741641 | 0.73 | CHRM2 (0.49) | HSD11B1CHRM2CHRM4CHRM5CHRM1 |
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 |