Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 12/20 | 0.54 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12686079 | 0.84 | ERN1 (0.58) | ERN1PIM1 | |
| SCHEMBL2788053 | 0.78 | ERN1 (0.78) | ERN1PIM1CA1CA2ALDH1A1 | |
| SCHEMBL29957335 | 0.78 | ERN1 (0.78) | ERN1PIM1CA1CA2ALDH1A1 | |
| SCHEMBL11408969 | 0.77 | ERN1 (0.75) | ERN1PIM1CA1CA2ALDH1A1 | |
| SCHEMBL5646596 | 0.77 | ERN1 (0.56) | ERN1CYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL13798734 | 0.77 | CA1 (0.58) | CA1CA2ALDH1A1CYP3A4CYP1A2 | |
| SCHEMBL2298759 | 0.75 | ERN1 (0.72) | ERN1PIM1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL21909910 | 0.75 | ALDH1A1 (0.36) | ERN1ALDH1A1TSHRCYP3A4CYP1A2 | |
| SCHEMBL118849 | 0.75 | ERN1 (0.64) | ERN1 | |
| SCHEMBL2925311 | 0.75 | ERN1 (0.64) | ERN1PIM1CA1CA2ALDH1A1 |
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-2012040454-A2 | SYNTHESIS OF SUBSTITUTED SALICYLALDEHYDE DERIVATIVES | NOVOMER, INC. (US) | 2012-03-29 | — | — | WO | disclosed |