Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 13/20 | 0.53 |
| ▸ | MAPT | P10636 | 8/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CASP1 | P29466 | 3/20 | 0.48 |
| ▸ | CASP7 | P55210 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 4/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CDK9 | P50750 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10048672 | 0.94 | GAA (0.52) | GAAMAPTKDM4ENPC1RAB9A | |
| SCHEMBL14963805 | 0.91 | GAA (0.49) | GAAMAPTKDM4ENPC1RAB9A | |
| SCHEMBL10120181 | 0.91 | GAA (0.49) | GAAMAPTKDM4ENPC1RAB9A | |
| SCHEMBL10120322 | 0.91 | GAA (0.46) | GAAMAPTKDM4ENPC1RAB9A | |
| SCHEMBL14963802 | 0.90 | GAA (0.48) | GAAMAPTKDM4ENPC1RAB9A | |
| SCHEMBL10120308 | 0.90 | GAA (0.47) | GAAMAPTKDM4ENPC1RAB9A | |
| SCHEMBL10120622 | 0.90 | GAA (0.50) | GAAMAPTKDM4ENPC1RAB9A | |
| SCHEMBL15179400 | 0.90 | KDM4E (0.48) | GAAMAPTKDM4ENPC1RAB9A | |
| SCHEMBL15179447 | 0.89 | KDM4E (0.53) | GAAMAPTKDM4ENPC1RAB9A | |
| SCHEMBL15179449 | 0.89 | GAA (0.46) | GAAMAPTKDM4ENPC1RAB9A |
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-2601194-B1 | FUSED-IMIDAZOYL COMPOUNDS USEFUL AS ANTIMICROBIAL AGENTS | MERCK SHARP & DOHME (US) | 2016-05-25 | — | — | EP | disclosed |