Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | KHK | P50053 | 1/20 | 0.35 |
| ▸ | USP8 | P40818 | 1/20 | 0.34 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10780291 | 0.92 | ALDH1A1 (0.41) | KDM4EGAAALDH1A1KHKUSP8 | |
| SCHEMBL10782113 | 0.82 | USP8 (0.38) | KDM4EUSP8SMN1; SMN2RXFP1 | |
| SCHEMBL10087543 | 0.82 | ALDH1A1 (0.47) | KDM4EGAAALDH1A1KHKUSP8 | |
| SCHEMBL29987465 | 0.82 | ALDH1A1 (0.47) | KDM4EGAAALDH1A1KHKUSP8 | |
| SCHEMBL3607648 | 0.80 | KDM4E (0.44) | KDM4EGAAALDH1A1KHKUSP8 | |
| SCHEMBL8200210 | 0.76 | ALDH1A1 (0.45) | KDM4EGAAALDH1A1KHKUSP8 | |
| SCHEMBL21074155 | 0.76 | USP8 (0.37) | USP8 | |
| SCHEMBL28965611 | 0.75 | ALDH1A1 (0.41) | KDM4EGAAALDH1A1KHKCSNK1A1 | |
| SCHEMBL11000333 | 0.75 | KDM4E (0.40) | KDM4EGAAALDH1A1KHKUSP8 | |
| SCHEMBL11117158 | 0.75 | ALDH1A1 (0.46) | KDM4EGAAALDH1A1KHKUSP8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0132476-B1 | ANTIMICROBIAL COMPOSITIONS | MERCK & CO. INC. (US) | 1987-07-15 | — | — | EP | disclosed |
| EP-0132476-A1 | Antimicrobial compositions | MERCK & CO. INC. (US) | 1985-02-13 | — | — | EP | disclosed |
| US-4402959-A | 3-AMINO-5,6-DIHALOPYRAZINE-2-CARBONITRILE | MERCK & CO., INC. (US) | 1983-09-06 | — | — | US | disclosed |