Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 6/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.42 |
| ▸ | CDK9 | P50750 | 4/20 | 0.42 |
| ▸ | GAK | O14976 | 1/20 | 0.42 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | LYN | P07948 | 1/20 | 0.42 |
| ▸ | RET | P07949 | 1/20 | 0.42 |
| ▸ | EPHA1 | P21709 | 1/20 | 0.42 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.42 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.42 |
| ▸ | EPHB2 | P29323 | 1/20 | 0.42 |
| ▸ | EPHA5 | P54756 | 1/20 | 0.42 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.42 |
| ▸ | EPHA4 | P54764 | 1/20 | 0.42 |
| ▸ | ADK | P55263 | 1/20 | 0.42 |
| ▸ | PTK6 | Q13882 | 1/20 | 0.42 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.42 |
| ▸ | RBP4 | P02753 | 1/20 | 0.41 |
| ▸ | SCD | O00767 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21238929 | 0.86 | CCNT1 (0.48) | ERBB2CCNT1CDK9GAKRIPK2 | |
| SCHEMBL17456015 | 0.85 | CDK9 (0.42) | ERBB2CCNT1CDK9RBP4TLR9 | |
| SCHEMBL17456068 | 0.84 | KDM4E (0.45) | RBP4TLR9TLR8TLR7ALDH1A1 | |
| SCHEMBL17455922 | 0.83 | ALDH1A1 (0.43) | RBP4SCDMEN1HTTKMT2A | |
| SCHEMBL17456003 | 0.83 | RBP4 (0.41) | RBP4SCDKMT2AALDH1A1 | |
| SCHEMBL17455956 | 0.81 | TMEM97 (0.51) | RBP4TLR9TLR8TLR7ALDH1A1 | |
| SCHEMBL17455921 | 0.79 | CYP11B1 (0.42) | RBP4ALDH1A1 | |
| SCHEMBL17456018 | 0.79 | CYP11B1 (0.42) | RBP4 | |
| SCHEMBL17456064 | 0.77 | RBP4 (0.47) | RBP4SCD | |
| SCHEMBL17455968 | 0.77 | SMN1; SMN2 (0.53) | DRD4ALDH1A1 |
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-2982666-B1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2019-08-07 | — | — | EP | disclosed |
| EP-2982666-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2016-02-10 | — | — | EP | disclosed |