Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.57 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.57 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 5/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | GSK3B | P49841 | 6/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | GNG2 | P59768 | 1/20 | 0.48 |
| ▸ | GNB1 | P62873 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4344454 | 0.88 | HTT (0.48) | HSP90AA1HSP90AB1HSD17B1PTPN1HTT | |
| SCHEMBL469649 | 0.85 | PKM (0.62) | HSP90AA1HSP90AB1PTPN1HTTALDH1A1 | |
| SCHEMBL30017193 | 0.85 | PKM (0.62) | HSP90AA1HSP90AB1PTPN1HTTALDH1A1 | |
| SCHEMBL2856590 | 0.85 | HTT (0.68) | HSP90AA1HSP90AB1HSD17B1PTPN1HTT | |
| SCHEMBL6756073 | 0.83 | HSP90AA1 (0.64) | HSP90AA1HSP90AB1HSD17B1PTPN1HTT | |
| SCHEMBL10462920 | 0.83 | PTPN1 (0.50) | HSP90AA1HSP90AB1PTPN1HTTALDH1A1 | |
| SCHEMBL10477831 | 0.82 | PTPN1 (0.48) | HSP90AA1HSP90AB1PTPN1HTTALDH1A1 | |
| SCHEMBL2054475 | 0.81 | GSK3B (0.55) | HSP90AA1HSP90AB1PTPN1HTTALDH1A1 | |
| SCHEMBL8647422 | 0.81 | GSK3B (0.50) | HSP90AA1HSP90AB1PTPN1HTTALDH1A1 | |
| SCHEMBL5465657 | 0.81 | HSP90AA1 (0.57) | HSP90AA1HSP90AB1HSD17B1PTPN1HTT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5691349-A | ANTICHOLESTEROL AGENTS; ATHEROSCLEROSIS | ZENECA LIMITED (GB) | 1997-11-25 | — | — | US | disclosed |
| EP-0654032-B1 | QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS | ZENECA LTD (GB) | 1997-10-15 | — | — | EP | disclosed |
| EP-0654032-A1 | QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS. | ZENECA LTD (GB) | 1995-05-24 | — | — | EP | disclosed |
| WO-1994003451-A1 | QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS | ZENECA LIMITED (GB) | 1994-02-17 | — | — | WO | disclosed |