Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 19/20 | 0.42 |
| ▸ | EML4 | Q9HC35 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 3/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | GAK | O14976 | 1/20 | 0.39 |
| ▸ | ACOX3 | O15254 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.39 |
| ▸ | ROS1 | P08922 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.39 |
| ▸ | FER | P16591 | 1/20 | 0.39 |
| ▸ | EPHA1 | P21709 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20004106 | 0.72 | ALK (0.51) | ALKKDREGFRRET | |
| SCHEMBL21443123 | 0.71 | ALK (0.37) | ALKEML4KDRHTR2BSRPK2 | |
| SCHEMBL24676285 | 0.69 | ALK (0.42) | ALK | |
| SCHEMBL21443119 | 0.69 | ALK (0.55) | ALKEML4KDRGAKACOX3 | |
| SCHEMBL28588337 | 0.69 | PIN1 (0.45) | ALKEML4SRPK2SRPK1 | |
| SCHEMBL898123 | 0.68 | ALK (0.81) | ALKEML4KDRGAKACOX3 | |
| SCHEMBL897814 | 0.66 | ALK (0.83) | ALKEML4KDRGAKACOX3 | |
| SCHEMBL29962312 | 0.66 | ALK (0.83) | ALKEML4KDRGAKACOX3 | |
| SCHEMBL21443144 | 0.66 | ALK (0.38) | ALKEML4PGRCLK1CLK2 | |
| SCHEMBL20004875 | 0.65 | GSK3B (0.35) | ALKEML4SRPK2SRPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2975024-B1 | TETRACYCLIC COMPOUNDS | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2018-03-28 | — | — | EP | disclosed |