Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HRH2 | P25021 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | ADAM17 | P78536 | 5/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL1504784 | 0.90 | ADAM17 (0.43) | ALDH1A1HRH2HRH1ADAM17TP53 | |
| SCHEMBL1503623 | 0.85 | ALDH1A1 (0.46) | ALDH1A1ADAM17TP53POLBCTNNB1 | |
| SCHEMBL1504825 | 0.83 | ALDH1A1 (0.45) | ALDH1A1HRH2HRH1ADAM17MAPT | |
| SCHEMBL1503650 | 0.83 | ALDH1A1 (0.59) | ALDH1A1TP53POLBCTNNB1TSHR | |
| SCHEMBL10275940 | 0.80 | ADAM17 (0.55) | HRH2HRH1ADAM17TP53 | |
| SCHEMBL10275951 | 0.80 | ADAM17 (0.55) | HRH2HRH1ADAM17TP53 | |
| SCHEMBL1504822 | 0.78 | ADAM17 (0.51) | HRH2HRH1ADAM17TP53 | |
| SCHEMBL1504735 | 0.77 | ADAM17 (0.68) | ADAM17 | |
| SCHEMBL1504939 | 0.75 | ADAM17 (0.60) | ALDH1A1ADAM17TP53MAPTPOLB | |
| SCHEMBL1504779 | 0.74 | ADAM17 (0.61) | ADAM17CHRM4 |
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-2011033009-A1 | N- [2-HYDROXYCARBAMOYL-2- (PIPERAZINYL) ETHYL] BENZAMIDE COMPOUNDS, THEIR PREPARATION AND THEIR USE AS TACE INHIBITORS | GALDERMA RESEARCH & DEVELOPMENT (FR) | 2011-03-24 | — | — | WO | disclosed |