Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P4HB | P07237 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TMPRSS4 | Q9NRS4 | 4/20 | 0.36 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.36 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.36 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.36 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.35 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
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 SCHEMBL7791921 | 0.99 | P4HB (0.38) | P4HBRAB9ANPC1CRHBPCRHR2 | |
| SCHEMBL7799908 | 0.86 | P4HB (0.40) | P4HBRAB9ANPC1CRHBPCRHR2 | |
| Hydrochloric Acid SCHEMBL7801204 | 0.85 | P4HB (0.40) | P4HBRAB9ANPC1CRHBPCRHR2 | |
| SCHEMBL8428730 | 0.85 | NPSR1 (0.44) | RAB9ANPC1CYP1A2CYP2C19NPFFR2 | |
| SCHEMBL7948494 | 0.84 | P4HB (0.40) | P4HBRAB9ANPC1CRHBPCRHR2 | |
| Hydrochloric Acid SCHEMBL8430572 | 0.84 | NPSR1 (0.44) | RAB9ANPC1CYP1A2CYP2C19NPFFR2 | |
| SCHEMBL8426437 | 0.84 | PLAU (0.38) | RAB9ANPC1CYP1A2CYP2C19CYP2D6 | |
| Hydrochloric Acid SCHEMBL8332845 | 0.83 | PLAU (0.37) | RAB9ANPC1CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL8428715 | 0.82 | SIRT1 (0.46) | RAB9ACYP1A2CYP2C19CYP2D6NPSR1 | |
| SCHEMBL8428392 | 0.82 | SCN5A (0.42) | CYP1A2CYP2C19NPFFR2NPSR1ALDH1A1 |
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-0794172-B1 | Orthosubstituted benzoylguanidines | HOECHST AG (DE) | 2001-10-24 | — | — | EP | claimed |