Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ2 | O43526 | 7/20 | 0.65 |
| ▸ | POLB | P06746 | 2/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 3/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.58 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.58 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.58 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL19977048 | 0.99 | KCNQ2 (0.64) | KCNQ2POLBNPSR1ALDH1A1LMNA | |
| SCHEMBL19977081 | 0.91 | KCNQ2 (0.54) | KCNQ2POLBNPSR1ALDH1A1LMNA | |
| SCHEMBL19977050 | 0.90 | MAPK1 (0.63) | KCNQ2POLBNPSR1ALDH1A1GAA | |
| SCHEMBL19977055 | 0.89 | POLB (0.61) | KCNQ2POLBALDH1A1LMNAKMT2A | |
| SCHEMBL19976934 | 0.89 | ALDH1A1 (0.64) | KCNQ2POLBNPSR1ALDH1A1LMNA | |
| SCHEMBL19977049 | 0.89 | ALDH1A1 (0.55) | KCNQ2POLBNPSR1ALDH1A1LMNA | |
| SCHEMBL19977058 | 0.86 | ALDH1A1 (0.60) | KCNQ2POLBNPSR1ALDH1A1LMNA | |
| SCHEMBL19977040 | 0.82 | MAPT (0.71) | KCNQ2NPSR1ALDH1A1LMNAGAA | |
| Hydrochloric Acid SCHEMBL2023240 | 0.81 | POLB (0.76) | POLBNPSR1ALDH1A1LMNAGAA | |
| SCHEMBL16999853 | 0.81 | KCNQ2 (0.56) | KCNQ2POLBNPSR1ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-9919998-B2 | Antibacterial agents: Nα-aroyl-N-aryl-phenylalaninamides | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2018-03-20 | — | — | US | disclosed |