Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.31 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.31 |
| ▸ | NPY1R | P25929 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20208740 | 1.00 | ALDH1A1 (0.38) | ALDH1A1KDM4EL3MBTL1HPGDLMNA | |
| SCHEMBL20208946 | 0.92 | ALDH1A1 (0.34) | ALDH1A1KDM4EL3MBTL1HPGDLMNA | |
| SCHEMBL20208799 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EL3MBTL1HPGDLMNA | |
| SCHEMBL20208800 | 0.91 | ALDH1A1 (0.37) | ALDH1A1KDM4EL3MBTL1HPGDLMNA | |
| SCHEMBL20208944 | 0.90 | ALDH1A1 (0.35) | ALDH1A1KDM4EL3MBTL1HPGDLMNA | |
| SCHEMBL20208636 | 0.88 | ALDH1A1 (0.38) | ALDH1A1KDM4EL3MBTL1HPGDLMNA | |
| SCHEMBL20208936 | 0.88 | ALDH1A1 (0.34) | ALDH1A1KDM4EL3MBTL1HPGDLMNA | |
| SCHEMBL20208953 | 0.87 | ADORA2A (0.36) | ALDH1A1KDM4EL3MBTL1HPGDLMNA | |
| SCHEMBL20209198 | 0.87 | ALOX5 (0.35) | ALDH1A1KDM4EL3MBTL1HPGDLMNA | |
| SCHEMBL20208942 | 0.85 | METAP1 (0.35) | ALDH1A1KDM4EL3MBTL1HPGDLMNA |
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-3544986-B1 | BRIDGED TRIARYLAMINES FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2020-12-23 | — | — | EP | disclosed |
| WO-2018095839-A1 | BRIDGED TRIARYLAMINES FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2018-05-31 | — | — | WO | disclosed |