Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 15/20 | 0.64 |
| ▸ | TDO2 | P48775 | 15/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | S1PR5 | Q9H228 | 5/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 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 | |
|---|---|---|---|---|
| SCHEMBL21138838 | 0.96 | IDO1 (0.61) | IDO1TDO2CYP2C9CYP3A4S1PR5 | |
| SCHEMBL21061068 | 0.79 | IDO1 (0.66) | IDO1TDO2CYP2C9CYP3A4S1PR5 | |
| SCHEMBL22635723 | 0.78 | IDO1 (1.00) | IDO1TDO2CYP2C9CYP3A4 | |
| SCHEMBL21138148 | 0.77 | IDO1 (0.66) | IDO1TDO2CYP2C9CYP3A4S1PR5 | |
| SCHEMBL21430773 | 0.77 | IDO1 (0.52) | IDO1TDO2CYP2C9CYP3A4 | |
| SCHEMBL21138418 | 0.74 | IDO1 (0.54) | IDO1TDO2CYP2C9CYP3A4S1PR5 | |
| SCHEMBL21408574 | 0.72 | IDO1 (0.52) | IDO1TDO2CYP2C9CYP3A4 | |
| SCHEMBL21138413 | 0.71 | IDO1 (0.50) | IDO1TDO2CYP2C9CYP3A4 | |
| SCHEMBL21138067 | 0.71 | IDO1 (0.47) | IDO1TDO2CYP2C9CYP3A4 | |
| SCHEMBL12569945 | 0.70 | GPR183 (0.49) | IDO1TDO2S1PR5 |
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-2019115586-A1 | OXALAMIDES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE | Phenex Discovery Verwaltungs-GmbH (DE) | 2019-06-20 | — | — | WO | disclosed |