Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 5/20 | 0.51 |
| ▸ | PLA2G2D | Q9UNK4 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9496777 | 1.00 | CETP (0.51) | CETPPLA2G2DALDH1A1CYP3A4TSHR | |
| SCHEMBL9678875 | 0.85 | CETP (0.59) | CETPPLA2G2DALDH1A1CYP3A4TSHR | |
| SCHEMBL10494244 | 0.83 | CETP (0.48) | CETPPLA2G2DALDH1A1CYP3A4TSHR | |
| SCHEMBL4948692 | 0.83 | CETP (0.63) | CETPCYP3A4TSHR | |
| SCHEMBL4948716 | 0.83 | CETP (0.63) | CETPCYP3A4TSHR | |
| SCHEMBL4946336 | 0.83 | CETP (0.63) | CETPCYP3A4TSHR | |
| SCHEMBL4948131 | 0.83 | CETP (0.63) | CETPCYP3A4TSHR | |
| SCHEMBL17817019 | 0.82 | CETP (0.49) | CETP | |
| SCHEMBL5618820 | 0.80 | CETP (0.56) | CETPALDH1A1CYP3A4TSHRMAPK1 | |
| SCHEMBL25371083 | 0.78 | CETP (0.57) | CETPPLA2G2DCYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5208223-A | Enzyme inhibitors | AMERICAN CYANAMID COMPANY (US) | 1993-05-04 | — | — | US | disclosed |
| US-5144045-A | Treatment of inflammatory related disorders | AMERICAN CYANAMID COMPANY (US) | 1992-09-01 | — | — | US | disclosed |