Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.44 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.43 |
| ▸ | GLS | O94925 | 1/20 | 0.42 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6090368 | 0.78 | GLS (0.66) | ADORA2AADORA2BSLC9A1GLSALDH1A1 | |
| SCHEMBL1226080 | 0.78 | CNR1 (0.58) | SLC9A1GRM2ALDH1A1MAPTHSD17B10 | |
| SCHEMBL10831013 | 0.78 | GLS (0.44) | GLSKDM4E | |
| SCHEMBL14216404 | 0.77 | SLC9A1 (0.43) | ADORA2AADORA2BSLC9A1GLSALDH1A1 | |
| SCHEMBL15833034 | 0.77 | ALDH1A1 (0.44) | ADORA2AADORA2BSLC9A1GLSALDH1A1 | |
| SCHEMBL2899658 | 0.77 | ALOX15 (0.49) | ADORA2AADORA2BSLC9A1GLSALDH1A1 | |
| SCHEMBL25153639 | 0.77 | SLC9A1 (0.43) | ADORA2AADORA2BSLC9A1GLSALDH1A1 | |
| SCHEMBL10832087 | 0.76 | SLC6A4 (0.47) | GLSKDM4ENPC1L3MBTL1KMT2A | |
| Iodide SCHEMBL2822777 | 0.76 | ALOX15 (0.47) | ADORA2AADORA2BSLC9A1GLSALDH1A1 | |
| SCHEMBL31481214 | 0.75 | HSD17B10 (0.65) | ALDH1A1HSD17B10KDM4ETSHRKMT2A |
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-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 |