Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 7/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | CASP2 | P42575 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL11604133 | 0.92 | KDM4E (0.38) | CASP3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11601116 | 0.92 | MAOA (0.40) | CASP3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11605019 | 0.90 | MAOA (0.42) | CASP3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL110590 | 0.76 | MAOA (0.57) | CASP3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL31085461 | 0.76 | MAOA (0.57) | CASP3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28114846 | 0.75 | MAOA (0.56) | CASP3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11604773 | 0.74 | GSK3B (0.35) | CASP3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL1024613 | 0.74 | GSK3B (0.46) | CASP3KDM4EALDH1A1HPGDHSD17B10 | |
| Zinc Ion SCHEMBL8672070 | 0.73 | MAOA (0.55) | CASP3KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL7078965 | 0.73 | GSK3B (0.50) | CASP3KDM4EALDH1A1HPGDHSD17B10 |
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 |