Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 1/20 | 0.39 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.38 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.38 |
| ▸ | EDNRB | P24530 | 2/20 | 0.38 |
| ▸ | EDNRA | P25101 | 2/20 | 0.38 |
| ▸ | LTA4H | P09960 | 2/20 | 0.37 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.35 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18115200 | 0.79 | MAPK8 (0.39) | MAPK8MAPK9MAPK10ENPP3ENPP1 | |
| SCHEMBL3038893 | 0.78 | LTA4H (0.54) | MAPK8MAPK9MAPK10LTA4HPOLB | |
| SCHEMBL372585 | 0.78 | LTA4H (0.43) | EDNRBEDNRALTA4H | |
| SCHEMBL29988503 | 0.75 | ALDH1A1 (0.43) | LTA4H | |
| SCHEMBL22412687 | 0.75 | MAOB (0.40) | EDNRBEDNRALTA4H | |
| SCHEMBL4314798 | 0.72 | LTA4H (0.64) | ENPP3ENPP1LTA4HDYRK1APOLB | |
| SCHEMBL29799257 | 0.71 | CA2 (0.49) | POLB | |
| SCHEMBL28565640 | 0.71 | CYP19A1 (0.48) | POLB | |
| SCHEMBL7015694 | 0.71 | MTNR1A (0.52) | LTA4H | |
| SCHEMBL29799247 | 0.71 | MTNR1A (0.52) | LTA4H |
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-107427527-B | Bile acid derivatives as FXR/TGR5 agonists and methods of use thereof | 英安塔制药有限公司 | 2021-01-26 | — | — | CN | disclosed |