Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.49 |
| ▸ | PDE2A | O00408 | 4/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.35 |
| ▸ | CETP | P11597 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | MPL | P40238 | 1/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.32 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.32 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6292042 | 0.88 | IDO1 (0.49) | IDO1PDE2AHTR2AHTR2CHTR2B | |
| SCHEMBL5198655 | 0.78 | PDE2A (0.51) | IDO1PDE2AHTR2AHTR2CHTR2B | |
| SCHEMBL1552832 | 0.75 | IDO1 (0.47) | IDO1PDE2APNMTCETPCA1 | |
| SCHEMBL1552834 | 0.75 | IDO1 (0.47) | IDO1PDE2APNMTCETPCA1 | |
| SCHEMBL8225527 | 0.74 | IDO1 (0.53) | IDO1PDE2AHTR2AHTR2CHTR2B | |
| SCHEMBL14402603 | 0.73 | PDE2A (0.48) | IDO1PDE2ACYP3A4CETP | |
| SCHEMBL13849947 | 0.73 | PDE2A (0.48) | IDO1PDE2ACYP3A4CETP | |
| SCHEMBL1127468 | 0.73 | IDO1 (0.49) | IDO1PDE2AHTR2AHTR2CHTR2B | |
| SCHEMBL6566 | 0.71 | IDO1 (0.62) | IDO1PDE2APNMTCA1CA2 | |
| SCHEMBL1167122 | 0.71 | IDO1 (0.58) | IDO1PDE2ACYP3A4CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005117869-A1 | COMBINATIONS COMPRISING (S)-AMLODIPINE AND A CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITOR, AND METHODS FOR REDUCING HYPERTENSION | SEPRACOR INC. (US) | 2005-12-15 | — | — | WO | disclosed |