Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | AGXT | P21549 | 2/20 | 0.38 |
| ▸ | MME | P08473 | 1/20 | 0.37 |
| ▸ | ECE1 | P42892 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | CA3 | P07451 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3245685 | 0.87 | ALDH1A1 (0.46) | ALDH1A1ATMTDP1GRM5PTGDR2 | |
| SCHEMBL6141336 | 0.79 | ALDH1A1 (0.39) | ALDH1A1ATMTDP1GRM5PTGDR2 | |
| SCHEMBL4231062 | 0.79 | NR3C2 (0.40) | ALDH1A1ATMTDP1GRM5PTGDR2 | |
| SCHEMBL6364007 | 0.74 | TRPV3 (0.39) | ALDH1A1GRM5PTGDR2NR3C2MME | |
| SCHEMBL29896412 | 0.74 | TRPV3 (0.39) | ALDH1A1GRM5PTGDR2NR3C2MME | |
| SCHEMBL29305005 | 0.74 | TRPV3 (0.41) | ALDH1A1ATMTDP1GRM5PTGDR2 | |
| SCHEMBL79584 | 0.74 | MME (0.46) | ALDH1A1GRM5PTGDR2NR3C2MME | |
| SCHEMBL14770099 | 0.74 | ALDH1A1 (0.35) | ALDH1A1ATMTDP1GRM5PTGDR2 | |
| SCHEMBL2764279 | 0.73 | ALDH1A1 (0.42) | ALDH1A1ATMTDP1GRM5PTGDR2 | |
| SCHEMBL22616325 | 0.73 | ALDH1A1 (0.42) | ALDH1A1ATMTDP1GRM5PTGDR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1651621-B1 | 2- (QUINOXALIN-5-YLSULFONYLAMINO) -BENZAMIDE COMPOUNDS AS CCK2 MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2008-08-06 | — | — | EP | claimed |