Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 8/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8396215 | 1.00 | ALDH1A1 (0.45) | ALDH1A1LMNAHPGDALOX12MAPT | |
| SCHEMBL7295938 | 1.00 | ALDH1A1 (0.45) | ALDH1A1LMNAHPGDALOX12MAPT | |
| SCHEMBL9195804 | 0.90 | MAPT (0.40) | ALDH1A1LMNAHPGDALOX12MAPT | |
| SCHEMBL7288790 | 0.90 | MAPT (0.40) | ALDH1A1LMNAHPGDALOX12MAPT | |
| SCHEMBL7288921 | 0.89 | ALDH1A1 (0.35) | ALDH1A1LMNAHPGDALOX12MAPT | |
| SCHEMBL7297618 | 0.89 | ALDH1A1 (0.44) | ALDH1A1LMNAHPGDALOX12MAPT | |
| SCHEMBL10561567 | 0.89 | LMNA (0.41) | ALDH1A1LMNAHPGDALOX12MAPT | |
| SCHEMBL9195585 | 0.86 | ALDH1A1 (0.47) | ALDH1A1LMNAMAPTHTTSMN1; SMN2 | |
| SCHEMBL7289652 | 0.86 | KMT2A (0.37) | ALDH1A1LMNAHPGDALOX12MAPT | |
| SCHEMBL7291466 | 0.86 | KMT2A (0.37) | ALDH1A1LMNAHPGDALOX12MAPT |
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-5965557-A | 2-(4-CHLOROPHENYL)-5,6-DIHYDRO-(1)BENZOTHIEPINO(5,4-C) PYRIDAZIN-3(2H)-ONE (7-OXIDE OR 7,7-DIOXIDE) OR THEIR OPTICAL ISOMERS, ADMINISTERED TO A SUBJECT IN NEED OF TREATMENT | YOSHITOMI PHARMACEUTICALS INDUSTRIES, LTD. (JP) | 1999-10-12 | — | — | US | disclosed |