Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | AKT1 | P31749 | 2/20 | 0.54 |
| ▸ | IDO1 | P14902 | 1/20 | 0.53 |
| ▸ | TDO2 | P48775 | 1/20 | 0.53 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL17643150 | 0.90 | ALDH1A1 (0.69) | ALDH1A1MEN1KMT2AGAAMAPT | |
| SCHEMBL17642999 | 0.89 | MEN1 (0.66) | ALDH1A1MEN1KMT2AGAAMAPT | |
| SCHEMBL17629396 | 0.87 | MEN1 (0.70) | ALDH1A1MEN1KMT2AGAAMAPT | |
| SCHEMBL21658050 | 0.85 | MEN1 (0.72) | ALDH1A1MEN1KMT2AGAAMAPT | |
| SCHEMBL17643146 | 0.85 | MEN1 (0.72) | ALDH1A1MEN1KMT2AGAAMAPT | |
| SCHEMBL14571460 | 0.85 | KMT2A (0.80) | ALDH1A1MEN1KMT2AGAAMAPT | |
| SCHEMBL17643209 | 0.85 | MEN1 (0.80) | ALDH1A1MEN1KMT2AGAAMAPT | |
| SCHEMBL17643007 | 0.84 | MEN1 (0.70) | ALDH1A1MEN1KMT2AGAAMAPT | |
| SCHEMBL28192745 | 0.84 | ALDH1A1 (0.67) | ALDH1A1MEN1KMT2AGAAMAPT | |
| SCHEMBL17643149 | 0.84 | KMT2A (0.74) | ALDH1A1MEN1KMT2AGAAMAPT |
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-3197982-B1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2020-05-06 | — | — | EP | disclosed |
| US-10544360-B2 | Materials for organic electroluminescent devices | MERCK PATENT GMBH (DE) | 2020-01-28 | — | — | US | disclosed |
| WO-2016045765-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2016-03-31 | — | — | WO | disclosed |