Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL9374946 | 0.85 | HSP90AA1 (0.47) | HSP90AA1ALDH1A1MEN1MAPTHPGD | |
| SCHEMBL9476283 | 0.80 | HSP90AA1 (0.50) | HSP90AA1ALDH1A1MEN1MAPTHPGD | |
| SCHEMBL9374953 | 0.77 | HSP90AA1 (0.47) | HSP90AA1ALDH1A1MEN1MAPTHTT | |
| SCHEMBL1508 | 0.77 | HSP90AA1 (0.55) | HSP90AA1ALDH1A1MAPTKMT2ACA2 | |
| SCHEMBL814 | 0.76 | HSP90AA1 (0.59) | HSP90AA1ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL7522374 | 0.76 | HSP90AA1 (0.59) | HSP90AA1ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL2574392 | 0.76 | HSP90AA1 (0.50) | HSP90AA1ALDH1A1MEN1MAPTHTT | |
| SCHEMBL7908281 | 0.73 | HSP90AA1 (0.44) | HSP90AA1ALDH1A1HTTSMN1; SMN2CA2 | |
| SCHEMBL7713573 | 0.73 | L3MBTL1 (0.49) | HSP90AA1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL23757989 | 0.72 | HSP90AA1 (0.55) | HSP90AA1ALDH1A1MEN1KMT2ACA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0154528-B1 | ALKENE, ALKYNE OR CYCLOALKYLENE DERIVATIVES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-12-11 | — | — | EP | disclosed |
| EP-0154528-A2 | Alkene, alkyne or cycloalkylene derivatives | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1985-09-11 | — | — | EP | disclosed |