Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.69 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.52 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.46 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.46 |
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 SCHEMBL8331430 | 0.99 | NPSR1 (0.67) | NPSR1TAS1R3TAS1R1MEN1KMT2A | |
| SCHEMBL8428558 | 0.86 | NPSR1 (0.55) | NPSR1TAS1R3TAS1R1MEN1KMT2A | |
| SCHEMBL8426329 | 0.85 | NPSR1 (0.54) | NPSR1TAS1R3TAS1R1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8333013 | 0.85 | NPSR1 (0.53) | NPSR1TAS1R3TAS1R1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8340432 | 0.84 | NPSR1 (0.53) | NPSR1TAS1R3TAS1R1MEN1KMT2A | |
| SCHEMBL8428571 | 0.84 | NPSR1 (0.52) | NPSR1TAS1R3TAS1R1MEN1KMT2A | |
| SCHEMBL8430502 | 0.83 | NPSR1 (0.51) | NPSR1ALDH1A1POLBP2RX1LMNA | |
| Hydrochloric Acid SCHEMBL8336186 | 0.82 | NPSR1 (0.51) | NPSR1TAS1R3TAS1R1MEN1KMT2A | |
| SCHEMBL12154445 | 0.82 | NPSR1 (1.00) | NPSR1TAS1R3TAS1R1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8336410 | 0.82 | NPSR1 (0.50) | NPSR1ALDH1A1POLBP2RX1LMNA |
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 |