Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8557494 | 0.92 | ALDH1A1 (0.39) | ALDH1A1NPSR1MAPTKDM4EHPGD | |
| SCHEMBL8554644 | 0.92 | ALDH1A1 (0.40) | ALDH1A1NPSR1MAPTKDM4EHPGD | |
| SCHEMBL8307013 | 0.88 | ALDH1A1 (0.45) | ALDH1A1NPSR1MAPTKDM4EHPGD | |
| SCHEMBL8557763 | 0.87 | ALDH1A1 (0.38) | ALDH1A1NPSR1MAPTKDM4EHPGD | |
| SCHEMBL8326230 | 0.85 | CYP19A1 (0.44) | ALDH1A1NPSR1MAPTKDM4EHPGD | |
| SCHEMBL9070589 | 0.82 | CA12 (0.43) | ALDH1A1NPSR1MAPTKDM4EHPGD | |
| SCHEMBL8306870 | 0.82 | ALDH1A1 (0.39) | ALDH1A1NPSR1MAPTKDM4EHPGD | |
| SCHEMBL8307015 | 0.80 | KDM4E (0.46) | ALDH1A1NPSR1MAPTKDM4EHPGD | |
| SCHEMBL4437800 | 0.79 | ALDH1A1 (0.52) | ALDH1A1NPSR1MAPTKDM4EHPGD | |
| SCHEMBL8308344 | 0.78 | ALDH1A1 (0.47) | ALDH1A1NPSR1MAPTKDM4EHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0685474-B1 | Oxalylamino-benzofuran- and benzothienyl-derivatives | BAYER AG (DE) | 1998-09-16 | — | — | EP | disclosed |
| US-5565488-A | ANTIINFLAMMATORY AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1996-10-15 | — | — | US | disclosed |
| EP-0685474-A1 | Oxalylamino-benzofuran- and benzothienyl-derivatives | BAYER AG (DE) | 1995-12-06 | — | — | EP | disclosed |