Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 6/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | LTB4R | Q15722 | 7/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL22212825 | 0.87 | KMT2A (0.40) | MEN1KMT2AADORA1MAPTTSHR | |
| SCHEMBL20829149 | 0.86 | MEN1 (0.40) | CYP19A1MEN1KMT2AADORA1ADORA3 | |
| SCHEMBL21972972 | 0.85 | MEN1 (0.40) | MEN1KMT2AADORA1ADORA3MAPT | |
| SCHEMBL20829146 | 0.77 | ADORA2A (0.38) | CYP19A1MEN1KMT2AADORA1MAPT | |
| SCHEMBL20829147 | 0.75 | MEN1 (0.45) | MEN1KMT2AADORA1ADORA3MAPT | |
| SCHEMBL22072005 | 0.73 | — | — | |
| SCHEMBL960513 | 0.72 | CYP19A1 (0.65) | CYP19A1MEN1KMT2AADORA1ADORA3 | |
| SCHEMBL22296632 | 0.71 | L3MBTL1 (0.54) | MEN1KMT2AADORA1ADORA3ADORA2B | |
| SCHEMBL20829145 | 0.71 | ADORA2A (0.41) | MEN1KMT2AADORA1MAPTTSHR | |
| SCHEMBL13203192 | 0.70 | CYP19A1 (0.63) | CYP19A1MEN1KMT2AADORA1ADORA3 |
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 |