Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 4/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11605569 | 0.85 | KDM4E (0.37) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL11605409 | 0.82 | KDM4E (0.40) | ALDH1A1HPGDHTTKDM4EGAA | |
| SCHEMBL11604127 | 0.80 | GSK3B (0.39) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL11605627 | 0.78 | KDM4E (0.35) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL30609814 | 0.75 | KDM4E (0.45) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL2359302 | 0.74 | GSK3B (0.42) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL10335607 | 0.72 | ALDH1A1 (0.42) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL11588296 | 0.70 | SOAT1 (0.42) | ALDH1A1HPGDHTTKDM4EGAA | |
| SCHEMBL11610346 | 0.69 | ALDH1A1 (0.39) | ALDH1A1KDM4EGAAGSK3BMAPT | |
| SCHEMBL21111964 | 0.69 | KDM4E (0.44) | ALDH1A1HPGDKDM4EGAAHSD17B10 |
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-4080399-A | REACTING N-CHLOROTHIOPHTHALIMIDE WITH UNSATURATED COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DT) | 1978-03-21 | — | — | US | disclosed |