Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14214201 | 0.96 | CYP2C9 (0.35) | CYP2C9 | |
| SCHEMBL9921560 | 0.91 | — | — | |
| SCHEMBL9921570 | 0.87 | CYP2C9 (0.35) | CYP2C9 | |
| SCHEMBL14214205 | 0.87 | — | — | |
| SCHEMBL16105098 | 0.86 | CYP2C9 (0.37) | CYP2C9 | |
| SCHEMBL9921565 | 0.83 | CNR2 (0.31) | — | |
| Trifluoroacetic Acid SCHEMBL9905080 | 0.82 | CYP2C9 (0.36) | CYP2C9 | |
| SCHEMBL9921619 | 0.78 | — | — | |
| SCHEMBL9921578 | 0.77 | CNR2 (0.32) | CYP2C9 | |
| SCHEMBL16105097 | 0.77 | CYP2C9 (0.31) | CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8846659-B2 | HIV integrase inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2014-09-30 | — | — | US | disclosed |
| US-8846659-B2 | HIV integrase inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2014-09-30 | — | — | US | disclosed |
| WO-2012078844-A1 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-06-14 | — | — | WO | disclosed |