Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 19/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 16/20 | 0.39 |
| ▸ | RXRA | P19793 | 3/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5541420 | 0.83 | CYP17A1 (0.41) | GRIN2BGRIN1RXRA | |
| SCHEMBL28413182 | 0.79 | GRIN2B (0.40) | GRIN2BGRIN1RXRAKCNH2 | |
| SCHEMBL5542548 | 0.79 | NISCH (0.42) | GRIN2BGRIN1RXRAKCNH2 | |
| SCHEMBL28295038 | 0.76 | GRM4 (0.41) | — | |
| SCHEMBL28018874 | 0.76 | HDAC4 (0.32) | GRIN2BGRIN1RXRA | |
| SCHEMBL1973038 | 0.74 | MAPK14 (0.36) | — | |
| SCHEMBL7497622 | 0.73 | CYP17A1 (0.42) | — | |
| SCHEMBL28019370 | 0.73 | GRIN1 (0.31) | GRIN2BGRIN1 | |
| SCHEMBL5536136 | 0.72 | FAAH (0.42) | — | |
| SCHEMBL435455 | 0.71 | CYP1A2 (0.38) | — |
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-106536507-A | 2,3-disubstituted pyridine compounds as TGF-beta inhibitors and methods of use | 里格尔药品股份有限公司 | 2017-03-22 | — | — | CN | disclosed |