Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 5/20 | 0.31 |
| ▸ | CNR1 | P21554 | 2/20 | 0.31 |
| ▸ | CCR2 | P41597 | 1/20 | 0.31 |
| ▸ | BRS3 | P32247 | 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 | |
|---|---|---|---|---|
| SCHEMBL14235960 | 0.85 | MMP1 (0.30) | — | |
| SCHEMBL14214198 | 0.85 | ALDH1A1 (0.32) | CCR2BRS3 | |
| SCHEMBL9905149 | 0.83 | CCR2 (0.31) | CCR2 | |
| SCHEMBL9921569 | 0.83 | CYP2C9 (0.35) | — | |
| SCHEMBL9921570 | 0.82 | CYP2C9 (0.35) | CNR2CNR1 | |
| SCHEMBL9921578 | 0.82 | CNR2 (0.32) | CNR2CNR1 | |
| SCHEMBL9921584 | 0.81 | SMN1; SMN2 (0.35) | CNR2CNR1 | |
| SCHEMBL14214201 | 0.81 | CYP2C9 (0.35) | CNR2 | |
| SCHEMBL9921583 | 0.79 | RAB9A (0.35) | CNR2CNR1 | |
| SCHEMBL16130154 | 0.78 | CYP19A1 (0.32) | — |
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 |