Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL4053114 | 0.76 | NPSR1 (0.40) | CYP2C19 | |
| SCHEMBL4622471 | 0.75 | NPSR1 (0.39) | CYP2C19 | |
| SCHEMBL10974958 | 0.74 | TSHR (0.35) | CYP2C19 | |
| SCHEMBL5873442 | 0.73 | AKR1C1 (0.34) | AKR1C1CYP2C19 | |
| SCHEMBL13009913 | 0.72 | CYP2C19 (0.41) | CYP2C19 | |
| SCHEMBL4554424 | 0.72 | CYP2C19 (0.41) | CYP2C19 | |
| SCHEMBL3170 | 0.70 | FFAR3 (0.37) | AKR1C1CYP2C19 | |
| Ethane SCHEMBL908993 | 0.70 | AKR1C1 (0.32) | AKR1C1CYP2C19 | |
| SCHEMBL3670181 | 0.69 | CYP2C19 (0.41) | CYP2C19 | |
| SCHEMBL988034 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103179991-B | In vivo imaging method for cancer | 通用电气健康护理有限公司 | 2016-08-24 | — | — | CN | disclosed |