Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.69 |
| ▸ | GLA | P06280 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.63 |
| ▸ | TSHR | P16473 | 2/20 | 0.63 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.59 |
| ▸ | DRD2 | P14416 | 1/20 | 0.57 |
| ▸ | DRD4 | P21917 | 1/20 | 0.57 |
| ▸ | DRD3 | P35462 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HTR6 | P50406 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8473238 | 0.84 | LMNA (0.66) | LMNAGLAALDH1A1TSHRGPR84 | |
| SCHEMBL14375226 | 0.83 | LMNA (0.64) | LMNAGLAALDH1A1TSHRGPR84 | |
| SCHEMBL2162689 | 0.82 | LMNA (1.00) | LMNAGLAALDH1A1TSHRGPR84 | |
| SCHEMBL15084330 | 0.82 | LMNA (0.55) | LMNAGLAALDH1A1TSHRGPR84 | |
| SCHEMBL3350921 | 0.79 | ACHE (0.50) | LMNAGLAALDH1A1TSHRDRD2 | |
| SCHEMBL3353653 | 0.79 | ACHE (0.50) | LMNAGLAALDH1A1TSHRDRD2 | |
| SCHEMBL15081946 | 0.79 | OPRL1 (0.53) | LMNAGLAALDH1A1TSHRGPR84 | |
| SCHEMBL12073915 | 0.78 | HDAC8 (0.51) | LMNAGLAGAAHDAC8HDAC6 | |
| SCHEMBL5196972 | 0.78 | LMNA (0.81) | LMNAGLAALDH1A1TSHRDRD2 | |
| SCHEMBL3353571 | 0.77 | ACHE (0.51) | LMNAGLAALDH1A1TSHRDRD2 |
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-3536319-A1 | NOVEL COMPOUNDS THAT ARE ERK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2019-09-11 | — | — | EP | disclosed |
| WO-2012058127-A2 | NOVEL COMPOUNDS THAT ARE ERK INHIBITORS | SCHERING CORPORATION (US) | 2012-05-03 | — | — | WO | disclosed |
| WO-2011163330-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS ERK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-12-29 | — | — | WO | disclosed |