Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.47 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.37 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.37 |
| ▸ | IKBKB | O14920 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.36 |
| ▸ | EDNRA | P25101 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31661900 | 0.74 | BCAT2 (0.57) | BCAT2LIMK1PLA2G10IKBKBKDM4E | |
| SCHEMBL1685092 | 0.74 | PIK3CD (0.54) | BCAT2GRM2NR1I2HCAR2PIK3CD | |
| SCHEMBL31661857 | 0.70 | SIRT3 (0.50) | BCAT2LIMK1CDK8 | |
| SCHEMBL31661830 | 0.70 | MKNK1 (0.54) | BCAT2LIMK1PLA2G10IKBKBKDM4E | |
| SCHEMBL16011605 | 0.69 | BCAT2 (0.59) | BCAT2LIMK1IKBKBKDM4EALDH1A1 | |
| SCHEMBL2231308 | 0.69 | BCAT2 (0.69) | BCAT2GRM2PLA2G10IKBKBKDM4E | |
| SCHEMBL31661820 | 0.69 | BCAT2 (0.58) | BCAT2LIMK1KDM4EALDH1A1POLB | |
| SCHEMBL12495840 | 0.68 | BCAT2 (0.62) | BCAT2IKBKBKDM4EALDH1A1POLB | |
| SCHEMBL27711486 | 0.68 | BCAT2 (0.49) | BCAT2LIMK1PLA2G10IKBKBKDM4E | |
| SCHEMBL27596977 | 0.68 | PIK3CD (0.40) | GRM2NR1I2HCAR2NPSR1PIK3CD |
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-2002017358-A2 | QUINUCLIDINE-SUBSTITUTED HETEROARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS) | PHARMACIA & UPJOHN COMPANY (US) | 2002-02-28 | — | — | WO | claimed |