Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ARG1 | P05089 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | TDO2 | P48775 | 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 | |
|---|---|---|---|---|
| SCHEMBL6944623 | 0.81 | CYP1A2 (0.37) | ARG1IDO1TDO2 | |
| SCHEMBL832963 | 0.79 | ARG1 (0.33) | ARG1IDO1TDO2 | |
| SCHEMBL21596598 | 0.79 | ARG1 (0.33) | ARG1IDO1TDO2 | |
| SCHEMBL27928439 | 0.79 | GAA (0.40) | ARG1IDO1TDO2 | |
| SCHEMBL28346473 | 0.78 | IDO1 (0.33) | IDO1TDO2 | |
| SCHEMBL6936693 | 0.76 | — | — | |
| SCHEMBL9680 | 0.76 | ARG1 (0.39) | ARG1 | |
| SCHEMBL2474412 | 0.76 | CYP2D6 (0.33) | IDO1TDO2 | |
| SCHEMBL11130247 | 0.76 | CYP2D6 (0.33) | IDO1TDO2 | |
| SCHEMBL14855613 | 0.74 | FFAR4 (0.36) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016091894-A1 | IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2016-06-16 | — | — | WO | claimed |
| CN-107074732-B | Improvements in or relating to organic compounds | 奇华顿股份有限公司 | 2020-08-18 | — | — | CN | disclosed |
| CN-107074732-B | Improvements in or relating to organic compounds | 奇华顿股份有限公司 | 2020-08-18 | — | — | CN | disclosed |
| CN-107074732-A | In organic compound or associated improvement | 奇华顿股份有限公司 | 2017-08-18 | — | — | CN | disclosed |
| WO-2016091894-A1 | IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2016-06-16 | — | — | WO | disclosed |