Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MPI | P34949 | 1/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | TRPM4 | Q8TD43 | 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 | |
|---|---|---|---|---|
| SCHEMBL2853501 | 0.94 | ALDH1A1 (0.38) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL10352837 | 0.94 | ALDH1A1 (0.41) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL6400555 | 0.85 | ESR1 (0.43) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL4810852 | 0.85 | ALDH1A1 (0.41) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL16505763 | 0.84 | ALDH1A1 (0.42) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL5886881 | 0.81 | KDM4E (0.48) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL5887333 | 0.79 | LTA4H (0.49) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL4810212 | 0.76 | KDM4E (0.40) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL5886864 | 0.76 | KIF11 (0.38) | ALDH1A1KDM4ECYP1B1CYP1A2CYP2C19 | |
| SCHEMBL1234768 | 0.73 | ALDH1A1 (0.39) | ALDH1A1KDM4EMEN1KMT2AHPGD |
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-2276723-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | Merck Patent GmbH (DE) | 2011-01-26 | — | — | EP | disclosed |
| WO-2009141026-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH, (DE) | 2009-11-26 | — | — | WO | disclosed |