Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.48 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.48 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.48 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.48 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.48 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8336410 | 0.99 | NPSR1 (0.50) | NPSR1P2RX1LMNACES2ALDH1A1 | |
| SCHEMBL8428558 | 0.86 | NPSR1 (0.55) | NPSR1P2RX1LMNACES2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8333013 | 0.85 | NPSR1 (0.53) | NPSR1P2RX1LMNACES2ALDH1A1 | |
| SCHEMBL8428571 | 0.84 | NPSR1 (0.52) | NPSR1P2RX1LMNACES2ALDH1A1 | |
| SCHEMBL8426329 | 0.83 | NPSR1 (0.54) | NPSR1P2RX1LMNACES2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8336186 | 0.83 | NPSR1 (0.51) | NPSR1P2RX1LMNACES2ALDH1A1 | |
| SCHEMBL8116963 | 0.83 | NPSR1 (0.54) | NPSR1P2RX1LMNACES2ALDH1A1 | |
| SCHEMBL8428607 | 0.83 | NPSR1 (0.69) | NPSR1P2RX1LMNACES2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8331430 | 0.82 | NPSR1 (0.67) | NPSR1P2RX1LMNACES2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8340432 | 0.82 | NPSR1 (0.53) | NPSR1P2RX1LMNACES2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0791577-B1 | Ortho-substituted benzylguanidines, process for their preparation and their use as medicament or diagnostic agent as well as medicament containing them | HOECHST AG (DE) | 1999-11-03 | — | — | EP | claimed |