Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16318110 | 0.97 | ACHE (0.34) | CYP2C9TSHRCYP2C19TDP1ACHE | |
| SCHEMBL22384120 | 0.94 | ACHE (0.36) | TDP1ACHECA1CA2CA4 | |
| SCHEMBL20368999 | 0.91 | — | — | |
| SCHEMBL23945122 | 0.88 | EPHX1 (0.37) | ACHEEPHX1 | |
| SCHEMBL23945125 | 0.88 | EPHX1 (0.37) | ACHEEPHX1 | |
| SCHEMBL20156487 | 0.88 | EPHX1 (0.37) | ACHEEPHX1 | |
| SCHEMBL7075565 | 0.83 | TDP1 (0.41) | CYP2C9TSHRCYP2C19TDP1ACHE | |
| SCHEMBL3001521 | 0.79 | ACHE (0.42) | CYP2C9TSHRCYP2C19TDP1ACHE | |
| SCHEMBL1269311 | 0.79 | EPHX1 (0.40) | CYP2C9TSHRCYP2C19TDP1ACHE | |
| SCHEMBL1269342 | 0.79 | CYP2C9 (0.44) | CYP2C9TSHRCYP2C19TDP1ACHE |
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-3008056-B1 | NOVEL GLP-1 RECEPTOR MODULATORS | CELGENE INT II SARL (CH) | 2020-12-09 | — | — | EP | disclosed |
| EP-3225618-B1 | BICYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2020-05-06 | — | — | EP | disclosed |