Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 19/20 | 0.52 |
| ▸ | TDO2 | P48775 | 7/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.48 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.48 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL20935328 | 1.00 | IDO1 (0.52) | IDO1TDO2CYP2C9CYP2C8CHRNA1 | |
| SCHEMBL20935363 | 1.00 | IDO1 (0.52) | IDO1TDO2CYP2C9CYP2C8CHRNA1 | |
| SCHEMBL22274771 | 0.92 | IDO1 (0.51) | IDO1TDO2CYP2C9CYP2C8CHRNA1 | |
| SCHEMBL19555596 | 0.92 | IDO1 (0.51) | IDO1TDO2CYP2C9CYP2C8CHRNA1 | |
| SCHEMBL20916335 | 0.92 | IDO1 (0.51) | IDO1TDO2CYP2C9CYP2C8CHRNA1 | |
| SCHEMBL20935434 | 0.92 | IDO1 (0.51) | IDO1TDO2CYP2C9CYP2C8CHRNA1 | |
| SCHEMBL22568483 | 0.86 | IDO1 (0.48) | IDO1TDO2CYP2C9CYP2C8CHRNA1 | |
| SCHEMBL20935350 | 0.85 | IDO1 (0.55) | IDO1TDO2CYP2C9CYP2C8CYP3A4 | |
| SCHEMBL22568207 | 0.85 | IDO1 (0.55) | IDO1TDO2CYP2C9CYP2C8CYP3A4 | |
| SCHEMBL22387545 | 0.84 | IDO1 (0.49) | IDO1TDO2CYP2C9CYP2C8CHRNA1 |
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-2019078968-A2 | CYCLIC COMPOUNDS AS IMMUNOMODULATING AGENTS | ANGEX PHARMACEUTICAL, INC. (US) | 2019-04-25 | — | — | WO | disclosed |