Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 7/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | L3MBTL3 | Q96JM7 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.34 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.34 |
| ▸ | L3MBTL4 | Q8NA19 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | ACACA | Q13085 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18288785 | 0.83 | ESR2 (0.43) | ABHD6L3MBTL1 | |
| SCHEMBL1507178 | 0.83 | GRM5 (0.38) | ABHD6GRM5HRH3 | |
| SCHEMBL867848 | 0.81 | ABHD6 (0.48) | ABHD6GRM5LMNA | |
| SCHEMBL28918731 | 0.81 | L3MBTL3 (0.35) | ADRA1AGRIN1GRIN2BL3MBTL3L3MBTL1 | |
| SCHEMBL28106897 | 0.79 | KDR (0.42) | KCNH2HRH3 | |
| SCHEMBL20356542 | 0.79 | ESR2 (0.42) | ABHD6 | |
| SCHEMBL29131003 | 0.76 | ATR (0.39) | ABHD6GRM5KCNH2 | |
| SCHEMBL30602455 | 0.76 | ATR (0.39) | ABHD6GRM5KCNH2 | |
| SCHEMBL18550294 | 0.75 | SMN1; SMN2 (0.41) | ABHD6GRM5L3MBTL1LMNA | |
| SCHEMBL2925583 | 0.74 | ADRA1A (0.53) | ADRA1AKCNH2HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106188038-A | One class has the compound of kinase inhibiting activity, preparation method and purposes | 中国科学院上海药物研究所 | 2016-12-07 | — | — | CN | disclosed |