Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.48 |
| ▸ | PARP1 | P09874 | 4/20 | 0.36 |
| ▸ | FAAH | O00519 | 2/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.34 |
| ▸ | SELE | P16581 | 1/20 | 0.34 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL6630356 | 0.81 | SIRT1 (0.50) | SIRT1PARP1FAAHNSD2KDM4E | |
| SCHEMBL6632529 | 0.80 | SIRT1 (0.47) | SIRT1PARP1KDM4EGLAMAPT | |
| SCHEMBL6633089 | 0.78 | SIRT1 (0.48) | SIRT1PARP1FAAHKDM4EALDH1A1 | |
| SCHEMBL6632850 | 0.74 | SIRT1 (0.65) | SIRT1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL3077375 | 0.72 | SIRT1 (0.77) | SIRT1PARP1KDM4EALDH1A1HPGD | |
| SCHEMBL6632649 | 0.71 | SIRT1 (0.53) | SIRT1PARP1KDM4EALDH1A1HPGD | |
| SCHEMBL6647601 | 0.69 | SIRT1 (0.53) | SIRT1PARP1KDM4EALDH1A1HPGD | |
| SCHEMBL6630704 | 0.68 | SIRT1 (0.70) | SIRT1NSD2KDM4EALDH1A1HPGD | |
| SCHEMBL6630988 | 0.68 | SIRT1 (0.64) | SIRT1PARP1KDM4EALDH1A1HPGD | |
| SCHEMBL6633917 | 0.66 | SIRT1 (0.53) | SIRT1PARP1KDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002016357-A2 | QUINUCLIDINE-SUBSTITUTED ARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS) | PHARMACIA & UPJOHN COMPANY (US) | 2002-02-28 | — | — | WO | disclosed |