Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACVR1 | Q04771 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.32 |
| ▸ | GRK2 | P25098 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14933485 | 0.86 | CYP1A1 (0.40) | ACVR1KMT2AMEN1HSP90AA1MAPT | |
| SCHEMBL14933580 | 0.80 | MAPK1 (0.41) | KMT2AMEN1HSP90AA1MAPTALDH1A1 | |
| SCHEMBL14933409 | 0.80 | MAPK1 (0.49) | ACVR1KMT2AMAPTALDH1A1CYP2C19 | |
| SCHEMBL13087158 | 0.74 | ACVR1 (0.43) | ACVR1KMT2AMEN1MAPTPIK3CA | |
| SCHEMBL20633107 | 0.72 | L3MBTL1 (0.45) | KMT2AMEN1MAPTALDH1A1TSHR | |
| SCHEMBL16483821 | 0.72 | PIK3CA (0.39) | ACVR1PIK3CAALDH1A1CYP2C19TSHR | |
| SCHEMBL21636097 | 0.71 | MAPK1 (0.47) | KMT2AMEN1HSP90AA1MAPTALDH1A1 | |
| SCHEMBL15945619 | 0.71 | KDM4E (0.46) | ACVR1KMT2AMEN1MAPTPIK3CA | |
| SCHEMBL16483579 | 0.71 | PIK3CA (0.42) | ACVR1PIK3CA | |
| SCHEMBL25569981 | 0.71 | L3MBTL1 (0.43) | KMT2AMEN1HSP90AA1MAPTALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3649213-B1 | COMPOSITION FOR ORGANIC ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2021-06-23 | — | — | EP | disclosed |
| WO-2019007867-A1 | COMPOSITION FOR ORGANIC ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2019-01-10 | — | — | WO | disclosed |