Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | MAPT | P10636 | 6/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | HPGD | P15428 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 4/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11512332 | 0.91 | KDM4E (0.42) | ALDH1A1MAPTKDM4EHPGDLMNA | |
| SCHEMBL22922726 | 0.91 | KDM4E (0.42) | ALDH1A1MAPTKDM4EHPGDLMNA | |
| SCHEMBL11511421 | 0.85 | ALDH1A1 (0.43) | ALDH1A1MAPTKDM4EHPGDLMNA | |
| SCHEMBL21436642 | 0.83 | KDM4E (0.38) | ALDH1A1MAPTKDM4EHPGDLMNA | |
| SCHEMBL21436644 | 0.83 | KDM4E (0.38) | ALDH1A1MAPTKDM4EHPGDLMNA | |
| SCHEMBL10996368 | 0.82 | GAA (0.43) | ALDH1A1MAPTKDM4EHPGDLMNA | |
| SCHEMBL10996371 | 0.82 | GAA (0.43) | ALDH1A1MAPTKDM4EHPGDLMNA | |
| SCHEMBL11004620 | 0.81 | GAA (0.41) | ALDH1A1MAPTKDM4EHPGDLMNA | |
| SCHEMBL10998937 | 0.81 | GAA (0.41) | ALDH1A1MAPTKDM4EHPGDLMNA | |
| SCHEMBL22922716 | 0.80 | ALDH1A1 (0.41) | ALDH1A1MAPTKDM4EHPGDL3MBTL1 |
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-4172142-A | DIURETICS FOR TREATMENT OF EDEMA | HOECHST AKTIENGESELLSCHAFT (DE) | 1979-10-23 | — | — | US | disclosed |