Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | F7 | P08709 | 1/20 | 0.39 |
| ▸ | F3 | P13726 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.38 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.38 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.38 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.38 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.38 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.38 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6451616 | 0.78 | HSD17B10 (0.47) | CYP1A2HSD17B10HTTF7F3 | |
| SCHEMBL17417700 | 0.75 | HSD17B10 (0.45) | CYP1A2HSD17B10HTTF7F3 | |
| SCHEMBL17417691 | 0.75 | F7 (0.50) | CYP1A2HSD17B10F7F3KDM4E | |
| SCHEMBL20551861 | 0.75 | KMT2A (0.49) | CYP1A2HSD17B10KDM4ERECQLLMNA | |
| SCHEMBL17417754 | 0.73 | HSD17B10 (0.43) | CYP1A2HSD17B10F7F3KDM4E | |
| SCHEMBL8226800 | 0.73 | GABRP (0.41) | CYP1A2HSD17B10KDM4ELDHALDHB | |
| SCHEMBL3995494 | 0.71 | GPR84 (0.51) | CYP1A2HSD17B10F7F3KDM4E | |
| SCHEMBL28732290 | 0.71 | PPARA (0.41) | KDM4EPPARGRAB9ALDHALDHB | |
| SCHEMBL28512376 | 0.71 | LDHA (0.47) | CYP1A2HSD17B10KDM4EPPARGLMNA | |
| SCHEMBL2045109 | 0.70 | HSD17B10 (0.43) | CYP1A2HSD17B10HTTF7F3 |
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-2016007630-A1 | QUINUCLIDINE COMPOUNDS FOR MODULATING ALPHA7 -NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVITY | ALPHARMAGEN, LLC (US) | 2016-01-14 | — | — | WO | disclosed |