Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.47 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.47 |
| ▸ | ABHD5 | Q8WTS1 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.40 |
| ▸ | JUN | P05412 | 1/20 | 0.39 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | KDM6B | O15054 | 2/20 | 0.38 |
| ▸ | KDM4A | O75164 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6943902 | 1.00 | ALDH1A1 (0.47) | ALDH1A1MAPTLMNANPSR1HTT | |
| SCHEMBL6664645 | 0.82 | ALDH1A1 (0.42) | ALDH1A1MAPTLMNANPSR1HTT | |
| SCHEMBL6664649 | 0.82 | ALDH1A1 (0.42) | ALDH1A1MAPTLMNANPSR1HTT | |
| SCHEMBL9330897 | 0.81 | ALDH1A1 (0.68) | ALDH1A1MAPTLMNANPSR1HTT | |
| SCHEMBL600479 | 0.81 | ALDH1A1 (0.68) | ALDH1A1MAPTLMNANPSR1HTT | |
| SCHEMBL600478 | 0.81 | ALDH1A1 (0.68) | ALDH1A1MAPTLMNANPSR1HTT | |
| Water SCHEMBL9776229 | 0.79 | ALDH1A1 (0.66) | ALDH1A1MAPTLMNANPSR1HTT | |
| Water SCHEMBL9776234 | 0.79 | ALDH1A1 (0.66) | ALDH1A1MAPTLMNANPSR1HTT | |
| SCHEMBL6944659 | 0.76 | ALDH1A1 (0.47) | ALDH1A1MAPTLMNANPSR1HTT | |
| SCHEMBL6944654 | 0.76 | ALDH1A1 (0.47) | ALDH1A1MAPTLMNANPSR1HTT |
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-6642246-B1 | Potent ligands for nicotinic acetylcholine receptors (nAChRs). Alzheimer's disease, cognitive or attention disorders, anxiety, depression, smoking cessation, neuroprotection, schizophrenia, analgesia, Tourette's syndrome, and Parkinson's | ASTRAZENECA AB (SE) | 2003-11-04 | — | — | US | disclosed |
| EP-1235826-B1 | QUINUCLIDINE ACRYLAMIDES | ASTRAZENECA AB (SE) | 2003-09-03 | — | — | EP | disclosed |
| EP-1235826-A1 | QUINUCLIDINE ACRYLAMIDES | AstraZeneca AB (SE) | 2002-09-04 | — | — | EP | disclosed |
| WO-2001029034-A1 | QUINUCLIDINE ACRYLAMIDES | ASTRAZENECA AB (SE) | 2001-04-26 | — | — | WO | disclosed |