Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAMK2A | Q9UQM7 | 3/20 | 0.41 |
| ▸ | THRA | P10827 | 7/20 | 0.39 |
| ▸ | THRB | P10828 | 7/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.36 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.35 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4754909 | 0.88 | THRA (0.36) | CAMK2ATHRATHRBCYP3A4CHRM1 | |
| SCHEMBL4752685 | 0.86 | MEP1B (0.38) | CYP3A4MEP1BCYP2C9CYP2C19 | |
| SCHEMBL16175471 | 0.85 | CYP3A4 (0.46) | CAMK2ATHRATHRBCYP3A4CHRM1 | |
| SCHEMBL2340437 | 0.85 | CYP3A4 (0.37) | THRBCYP3A4MEP1BCYP2C9CYP2C19 | |
| SCHEMBL13481896 | 0.85 | CYP3A4 (0.42) | CYP3A4MEP1BCYP2C9CYP2C19 | |
| SCHEMBL3038920 | 0.84 | CYP1A2 (0.41) | CAMK2ATHRATHRBGRIK1 | |
| SCHEMBL4752770 | 0.84 | CYP1A2 (0.41) | CAMK2ATHRATHRBGRIK1 | |
| SCHEMBL3023318 | 0.83 | CYP3A4 (0.38) | CYP3A4MEP1BCYP2C9CYP2C19 | |
| SCHEMBL1344613 | 0.82 | CYP3A4 (0.55) | CAMK2ATHRATHRBCYP3A4CHRM1 | |
| SCHEMBL13236609 | 0.82 | CAMK2A (0.39) | CAMK2ATHRATHRBCYP3A4CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008157273-A1 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-12-24 | — | — | WO | disclosed |
| WO-2008157330-A1 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-12-24 | — | — | WO | disclosed |