Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | PTGDR2 | Q9Y5Y4 | 11/20 | 0.42 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | CETP | P11597 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.38 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRB | P28702 | 1/20 | 0.38 |
| ▸ | RXRG | P48443 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13059699 | 0.86 | ABCB11 (0.43) | ABCB11PTGDR2ABL1CETPPTGS2 | |
| SCHEMBL13082656 | 0.83 | ABL1 (0.54) | ABL1PTGS2 | |
| SCHEMBL18190747 | 0.73 | ABCB11 (0.44) | ABCB11PTGDR2SCN8ASCN10A | |
| SCHEMBL16957141 | 0.73 | MRGPRX4 (0.40) | PTGDR2SCN8ASCN10ARXRARXRB | |
| SCHEMBL18586794 | 0.73 | PDE10A (0.43) | PTGDR2CYP3A4CYP3A5PTGS2 | |
| SCHEMBL18586921 | 0.73 | PIK3CA (0.44) | PTGS2 | |
| SCHEMBL15674568 | 0.72 | PDE10A (0.49) | — | |
| SCHEMBL4412958 | 0.71 | KIF11 (0.52) | PTGS2 | |
| SCHEMBL8160406 | 0.70 | L3MBTL1 (0.42) | CYP3A4SCN8ASCN10ARXRARXRB | |
| SCHEMBL16399585 | 0.70 | PDE10A (0.41) | ABL1PTGS2RXRARXRBRXRG |
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 |
|---|---|---|---|---|---|---|---|
| US-8445480-B2 | CETP inhibitors derived from benzoxazole arylamides | MERCK SHARP & DOHME CORP. (US) | 2013-05-21 | — | — | US | disclosed |