Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.64 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.62 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.62 |
| ▸ | LTA4H | P09960 | 2/20 | 0.58 |
| ▸ | ESR1 | P03372 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.46 |
| ▸ | ESRRG | P62508 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL26914699 | 0.83 | CYP1A2 (0.60) | HRH3LTA4HKCNH2 | |
| SCHEMBL17215124 | 0.83 | GAA (0.43) | HRH3KEAP1NFE2L2LTA4HALDH1A1 | |
| SCHEMBL28266470 | 0.83 | HRH3 (0.64) | HRH3KEAP1NFE2L2LTA4HKDM4E | |
| SCHEMBL9491553 | 0.82 | HRH3 (0.41) | HRH3KEAP1NFE2L2LTA4HESR1 | |
| SCHEMBL1823685 | 0.80 | LTA4H (0.48) | LTA4HKDM4ESMN1; SMN2 | |
| SCHEMBL4607528 | 0.80 | HRH3 (0.70) | HRH3KEAP1NFE2L2LTA4HKDM4E | |
| SCHEMBL4087894 | 0.80 | HRH3 (0.59) | HRH3KEAP1NFE2L2LTA4HESR1 | |
| SCHEMBL7774589 | 0.80 | LMNA (0.49) | LTA4HKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL9570661 | 0.80 | HRH3 (0.44) | HRH3 | |
| SCHEMBL5514418 | 0.80 | HRH3 (0.44) | HRH3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4335119-A | Quick-acting diuretic compositions | ROHM, PHARMA GMBH (DE) | 1982-06-15 | — | — | US | disclosed |
| US-4252809-A | DIURETICS | ROHM PHARMA GMBH (DE) | 1981-02-24 | — | — | US | disclosed |