Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 10/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 10/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20829147 | 0.92 | MEN1 (0.45) | ADORA2AADORA1MEN1KMT2AMAPT | |
| SCHEMBL20829146 | 0.89 | ADORA2A (0.38) | ADORA2AADORA1MEN1KMT2AMAPT | |
| SCHEMBL21972969 | 0.88 | L3MBTL1 (0.41) | ADORA2AADORA1MEN1KMT2AMAPT | |
| SCHEMBL20829149 | 0.86 | MEN1 (0.40) | ADORA2AADORA1MEN1KMT2AMAPT | |
| SCHEMBL21972972 | 0.85 | MEN1 (0.40) | ADORA2AADORA1MEN1KMT2AMAPT | |
| SCHEMBL21233511 | 0.83 | KDM1A (0.31) | — | |
| SCHEMBL20829144 | 0.82 | RAB9A (0.43) | ADORA1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL21973501 | 0.79 | IKBKB (0.33) | — | |
| SCHEMBL22212825 | 0.73 | KMT2A (0.40) | ADORA2AADORA1MEN1KMT2AMAPT | |
| SCHEMBL25923595 | 0.73 | L3MBTL1 (0.43) | ADORA2AADORA1MEN1KMT2AMAPT |
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-3197982-B1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2020-05-06 | — | — | EP | disclosed |
| WO-2019052933-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2019-03-21 | — | — | WO | disclosed |