Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 17/20 | 0.60 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
| ▸ | LCK | P06239 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 1/20 | 0.48 |
| ▸ | JAK3 | P52333 | 1/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4516307 | 0.87 | DHFR (0.73) | DHFRADORA2ALCKKDRJAK3 | |
| SCHEMBL28019351 | 0.86 | DHFR (0.58) | DHFRADORA2AMAP4K4 | |
| SCHEMBL15638184 | 0.84 | DHFR (0.52) | DHFRMAP4K4 | |
| SCHEMBL30117446 | 0.83 | DHFR (0.54) | DHFRMAP4K4 | |
| SCHEMBL15638503 | 0.83 | DHFR (0.54) | DHFRMAP4K4 | |
| SCHEMBL28019341 | 0.79 | LCK (0.78) | DHFRADORA2ALCKKDRJAK3 | |
| SCHEMBL15639246 | 0.79 | MAP4K4 (0.70) | DHFRADORA2AMAP4K4 | |
| SCHEMBL15638247 | 0.77 | DHFR (0.52) | DHFRADORA2AMAP4K4 | |
| SCHEMBL15638515 | 0.77 | TGFBR1 (0.64) | MAP4K4 | |
| SCHEMBL28019364 | 0.76 | TGFBR1 (0.63) | LCKKDRJAK3MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104837832-B | GDF-8 inhibitors | 里格尔药品股份有限公司 | 2019-04-26 | — | — | CN | claimed |
| CN-104837832-A | GDF-8 inhibitors | RIGEL PHARMACEUTICALS INC | 2015-08-12 | — | — | CN | claimed |
| CN-104837832-B | GDF-8 inhibitors | 里格尔药品股份有限公司 | 2019-04-26 | — | — | CN | disclosed |
| 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 |
| CN-104837832-A | GDF-8 inhibitors | RIGEL PHARMACEUTICALS INC | 2015-08-12 | — | — | CN | disclosed |