Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT6 | Q8N6T7 | 2/20 | 0.44 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | HPGDS | O60760 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.39 |
| ▸ | FEN1 | P39748 | 2/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | MC3R | P41968 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | HTR5A | P47898 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29551864 | 0.78 | HPGDS (0.63) | SIRT6DHODHHPGDSPIM1PIM3 | |
| SCHEMBL29907612 | 0.75 | NPC1 (0.50) | SIRT6HPGDSKMT2APIM1PIM3 | |
| SCHEMBL2933552 | 0.74 | LDHA (0.53) | SIRT6GSK3BTSHR | |
| SCHEMBL2635320 | 0.73 | SIRT6 (0.73) | SIRT6KMT2AGSK3BADORA3TSHR | |
| SCHEMBL4651415 | 0.72 | P4HA1 (0.66) | DHODHHPGDSTTRNPC1P4HTM | |
| SCHEMBL379465 | 0.71 | LDHA (0.47) | SIRT6HPGDSKMT2AGSK3BALOX5AP | |
| SCHEMBL27646753 | 0.71 | P4HTM (0.49) | SIRT6HPGDSKMT2ATGFBR1GSK3B | |
| Hydrochloric Acid SCHEMBL27917292 | 0.71 | SIRT6 (0.70) | SIRT6KMT2AGSK3BADORA3TSHR | |
| SCHEMBL29907667 | 0.70 | KDM4C (0.49) | SIRT6HPGDSKMT2ATGFBR1GSK3B | |
| SCHEMBL29600561 | 0.70 | ATR (0.52) | PIM1PIM3 |
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-105566311-A | Oxazole and isoxazole crac modulators | LUPIN LTD | 2016-05-11 | — | — | CN | disclosed |
| CN-103228636-B | Calcium modulators of oxazole and isoxazole calcium release activation | LUPIN LTD. (IN) | 2016-02-10 | — | — | CN | disclosed |