Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | PGK2 | P07205 | 1/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.31 |
| ▸ | MBOAT4 | Q96T53 | 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 | |
|---|---|---|---|---|
| SCHEMBL1803971 | 0.76 | ESR1 (0.32) | — | |
| SCHEMBL662302 | 0.76 | PGK1 (0.38) | DAOPGK1PGK2MRGPRX4 | |
| SCHEMBL1659677 | 0.76 | DAO (0.41) | DAOPGK1PGK2MRGPRX4MBOAT4 | |
| SCHEMBL979900 | 0.75 | NOTUM (0.32) | PGK1PGK2 | |
| SCHEMBL472558 | 0.74 | TSHR (0.43) | DAOPGK1PGK2MRGPRX4 | |
| SCHEMBL330030 | 0.74 | IDO1 (0.52) | — | |
| SCHEMBL17092743 | 0.74 | CA1 (0.38) | DAOPGK1PGK2MRGPRX4MBOAT4 | |
| SCHEMBL21777546 | 0.74 | LOXL2 (0.52) | — | |
| SCHEMBL15018988 | 0.74 | DAO (0.40) | DAOPGK1PGK2MRGPRX4MBOAT4 | |
| SCHEMBL3714185 | 0.74 | TSHR (0.54) | DAO |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107428690-A | Mutation IDH1 inhibitor available for treating cancer | 美国政府健康及人类服务部 | 2017-12-01 | — | — | CN | disclosed |
| WO-2016087593-A1 | NOVEL FUNGICIDAL QUINOLINYLAMIDINES | SYNGENTA PARTICIPATIONS AG (CH) | 2016-06-09 | — | — | WO | disclosed |