Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 6/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.34 |
| ▸ | LTB4R | Q15722 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL20829146 | 0.92 | ADORA2A (0.38) | MEN1KMT2ACYP19A1ADORA1ADORA2A | |
| SCHEMBL20829147 | 0.89 | MEN1 (0.45) | MEN1KMT2AADORA1ADORA3ADORA2A | |
| SCHEMBL20829148 | 0.86 | CYP19A1 (0.40) | MEN1KMT2ACYP19A1ADORA1ADORA3 | |
| SCHEMBL20829145 | 0.86 | ADORA2A (0.41) | MEN1KMT2AADORA1ADORA2AMAPT | |
| SCHEMBL21973501 | 0.83 | IKBKB (0.33) | — | |
| SCHEMBL21233511 | 0.81 | KDM1A (0.31) | — | |
| SCHEMBL21972969 | 0.77 | L3MBTL1 (0.41) | MEN1KMT2AADORA1ADORA3ADORA2B | |
| SCHEMBL22212825 | 0.74 | KMT2A (0.40) | MEN1KMT2AADORA1ADORA2AMAPT | |
| SCHEMBL21972972 | 0.71 | MEN1 (0.40) | MEN1KMT2AADORA1ADORA3ADORA2A | |
| SCHEMBL24930875 | 0.70 | — | — |
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 |