Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.53 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.53 |
| ▸ | CDC7 | O00311 | 2/20 | 0.49 |
| ▸ | DBF4 | Q9UBU7 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.45 |
| ▸ | CAMKK1 | Q8N5S9 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | JAK1 | P23458 | 1/20 | 0.43 |
| ▸ | JAK3 | P52333 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1267592 | 0.80 | CDC7 (0.48) | MAP2K1HSD11B1CDC7DBF4CNR2 | |
| SCHEMBL16472206 | 0.80 | MAP2K1 (0.66) | MAP2K1CNR2CAMKK2CYP2D6CYP2C9 | |
| SCHEMBL858124 | 0.78 | MAP2K1 (0.56) | MAP2K1HSD11B1CDC7DBF4CNR2 | |
| SCHEMBL858109 | 0.77 | MAP2K1 (0.57) | MAP2K1HSD11B1CNR2CAMKK2CAMKK1 | |
| SCHEMBL29396186 | 0.76 | MAP2K1 (0.68) | MAP2K1CNR2CAMKK2CYP2D6CYP2C9 | |
| SCHEMBL12500787 | 0.76 | MAP2K1 (0.68) | MAP2K1CNR2CAMKK2CYP2D6CYP2C9 | |
| SCHEMBL8515059 | 0.74 | CNR2 (0.57) | MAP2K1HSD11B1CNR2CAMKK2CAMKK1 | |
| SCHEMBL30503672 | 0.74 | HSD11B1 (0.57) | HSD11B1HPGDTSHRPOLBL3MBTL1 | |
| SCHEMBL1267537 | 0.74 | MAP2K1 (0.48) | MAP2K1HSD11B1CDC7DBF4CNR2 | |
| SCHEMBL30368631 | 0.73 | MAP2K1 (0.64) | MAP2K1CNR2CAMKK2CYP2D6CYP2C9 |
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-3233841-A1 | INDOLE AND AZAINDOLES DERIVATIVES AND THEIR USE IN NEURODEGENERATIVE DISEASES | Merck Patent GmbH (DE) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016100281-A1 | INDOLE AND AZAINDOLES DERIVATIVES AND THEIR USE IN NEURODEGENERATIVE DISEASES | MERCK PATENT GMBH (DE) | 2016-06-23 | — | — | WO | disclosed |