Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.47 |
| ▸ | MLYCD | O95822 | 1/20 | 0.38 |
| ▸ | SCD | O00767 | 2/20 | 0.36 |
| ▸ | PARP1 | P09874 | 4/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
| ▸ | CDK7 | P50613 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.33 |
| ▸ | WNT3A | P56704 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL30810243 | 0.74 | BCAT2 (0.42) | SCDPARP1CDC7ROCK2MAP4K4 | |
| SCHEMBL6633089 | 0.72 | SIRT1 (0.48) | SIRT1SCDPARP1CDC7ROCK2 | |
| SCHEMBL3077375 | 0.71 | SIRT1 (0.77) | SIRT1PARP1IRAK4MAPTCTNNB1 | |
| SCHEMBL6630237 | 0.71 | SIRT1 (0.53) | SIRT1PARP1MAPTKMT2AALDH1A1 | |
| SCHEMBL6650786 | 0.68 | SIRT1 (0.53) | SIRT1MAPTKDM4EALDH1A1HPGD | |
| SCHEMBL149060 | 0.67 | SIRT1 (0.55) | SIRT1PARP1IRAK4MAPTCTNNB1 | |
| SCHEMBL6633843 | 0.65 | SIRT1 (0.53) | SIRT1PARP1ROCK2MAP4K4PIM1 | |
| SCHEMBL1030659 | 0.65 | SIRT1 (1.00) | SIRT1MAPTCTNNB1LMNAKMT2A | |
| SCHEMBL27839664 | 0.64 | SIRT1 (0.60) | SIRT1PARP1IRAK4MAPTCTNNB1 | |
| SCHEMBL6630850 | 0.64 | SIRT1 (0.59) | SIRT1MAPTKDM4EALDH1A1HPGD |
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-1381603-A2 | QUINUCLIDINE-SUBSTITUEDARYL MOIETIES FOR TREATMENT OF DISEASE ( NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS ) | PHARMACIA & UPJOHN COMPANY (US) | 2004-01-21 | — | — | EP | claimed |
| WO-2002016358-A2 | QUINUCLIDINE-SUBSTITUTED ARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS) | PHARMACIA & UPJOHN COMPANY (US) | 2002-02-28 | — | — | WO | claimed |