Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.52 |
| ▸ | GLA | P06280 | 6/20 | 0.52 |
| ▸ | ATM | Q13315 | 6/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | KLK7 | P49862 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 6/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.51 |
| ▸ | CASP1 | P29466 | 5/20 | 0.51 |
| ▸ | CASP7 | P55210 | 5/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.51 |
| ▸ | IGLV6-57 | P01721 | 4/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 5/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 6/20 | 0.48 |
| ▸ | MEN1 | O00255 | 6/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5307226 | 0.90 | ALDH1A1 (0.56) | ALDH1A1NPSR1KDM4EGLAATM | |
| SCHEMBL6979740 | 0.88 | ALDH1A1 (0.52) | ALDH1A1NPSR1KDM4EGLAATM | |
| SCHEMBL12510066 | 0.84 | ALDH1A1 (0.55) | ALDH1A1NPSR1KDM4EGLAATM | |
| SCHEMBL11584450 | 0.81 | ALDH1A1 (0.67) | ALDH1A1NPSR1KDM4EGLAATM | |
| SCHEMBL20796624 | 0.80 | ALDH1A1 (0.63) | ALDH1A1NPSR1KDM4EGLAATM | |
| SCHEMBL21456977 | 0.78 | ALDH1A1 (0.67) | ALDH1A1NPSR1KDM4EGLAATM | |
| SCHEMBL6982766 | 0.78 | ALDH1A1 (0.58) | ALDH1A1NPSR1KDM4EGLAATM | |
| SCHEMBL11583495 | 0.78 | ALDH1A1 (0.55) | ALDH1A1NPSR1KDM4EGLAATM | |
| SCHEMBL29493311 | 0.77 | ALDH1A1 (0.68) | ALDH1A1NPSR1KDM4EGLAATM | |
| SCHEMBL29952780 | 0.77 | ALDH1A1 (0.63) | ALDH1A1NPSR1KDM4EGLAATM |
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 |
|---|---|---|---|---|---|---|---|
| US-8377712-B2 | Compositions and methods for the detection of chemical warfare agents | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2013-02-19 | — | — | US | disclosed |
| US-20120122228-A1 | Compositions And Methods For The Detection Of Chemical Warfare Agents | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2012-05-17 | — | — | US | disclosed |