Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APAF1 | O14727 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 4/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.44 |
| ▸ | SRC | P12931 | 1/20 | 0.44 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TDO2 | P48775 | 2/20 | 0.40 |
| ▸ | IDO2 | Q6ZQW0 | 2/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30639106 | 1.00 | APAF1 (0.48) | APAF1IDO1ADORA3ABL1PDGFRB | |
| SCHEMBL26614207 | 0.88 | APAF1 (0.57) | APAF1IDO1TDO2IDO2EGFR | |
| SCHEMBL26855829 | 0.84 | APAF1 (0.48) | APAF1IDO1TDO2IDO2EGFR | |
| SCHEMBL30639088 | 0.84 | APAF1 (0.48) | APAF1IDO1TDO2IDO2EGFR | |
| SCHEMBL26614284 | 0.83 | APAF1 (0.59) | APAF1IDO1TDO2IDO2EGFR | |
| SCHEMBL26614184 | 0.82 | APAF1 (0.48) | APAF1IDO1TDO2IDO2EGFR | |
| SCHEMBL30639077 | 0.82 | APAF1 (0.48) | APAF1IDO1TDO2IDO2EGFR | |
| SCHEMBL26855813 | 0.81 | APAF1 (0.52) | APAF1IDO1TDO2IDO2EGFR | |
| SCHEMBL30639091 | 0.80 | APAF1 (0.61) | APAF1IDO1TDO2IDO2EGFR | |
| SCHEMBL26614118 | 0.80 | APAF1 (0.61) | APAF1IDO1TDO2IDO2EGFR |
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-2023211977-A1 | TRYPTANTHRIN DERIVATIVES AND USES THEREOF | VISCIENT BIO, INC. (US) | 2023-11-02 | — | — | WO | disclosed |