Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 4/20 | 0.53 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.45 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.44 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | BRD1 | O95696 | 1/20 | 0.43 |
| ▸ | METAP2 | P50579 | 1/20 | 0.43 |
| ▸ | S100B | P04271 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10146672 | 0.86 | PARG (0.46) | MAPK14ATAD2ALDH1A1SMN1; SMN2GLA | |
| SCHEMBL10145948 | 0.84 | GRM2 (0.49) | MAPK14CHEK1GRM2METAP2 | |
| SCHEMBL10146676 | 0.82 | GRM2 (0.47) | MAPK14ALDH1A1SMN1; SMN2CHEK1BRD4 | |
| SCHEMBL10146668 | 0.82 | GRM2 (0.70) | GRM2METAP2 | |
| SCHEMBL10145941 | 0.82 | GRM2 (0.47) | MAPK14ALDH1A1CHEK1GRM2METAP2 | |
| SCHEMBL10145952 | 0.80 | GRM2 (0.45) | MAPK14KDM4EGRM2METAP2MAPT | |
| SCHEMBL10146004 | 0.79 | BRD4 (0.48) | ALDH1A1KDM4EBRD4GRM2MAPT | |
| SCHEMBL10146671 | 0.79 | PARG (0.51) | MAPK14CHEK1GRM2METAP2 | |
| SCHEMBL14992133 | 0.77 | MAPK14 (0.50) | MAPK14ALDH1A1SMN1; SMN2GLAKDM4E | |
| SCHEMBL10146326 | 0.77 | PIK3CA (0.42) | MAPK14ALDH1A1SMN1; SMN2HSD17B10KDM4E |
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-2012021382-A1 | POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 | MERCK SHARP & DOHME CORP. (US) | 2012-02-16 | — | — | WO | disclosed |