Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 7/20 | 0.75 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.75 |
| ▸ | SLC10A2 | Q12908 | 2/20 | 0.75 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.75 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.75 |
| ▸ | VDR | P11473 | 4/20 | 0.68 |
| ▸ | CASP7 | P55210 | 3/20 | 0.68 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.68 |
| ▸ | MAPT | P10636 | 3/20 | 0.68 |
| ▸ | USP2 | O75604 | 3/20 | 0.68 |
| ▸ | TP53 | P04637 | 2/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.68 |
| ▸ | BLM | P54132 | 2/20 | 0.68 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.68 |
| ▸ | LMNA | P02545 | 2/20 | 0.68 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.68 |
| ▸ | MDM4 | O15151 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
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 | |
|---|---|---|---|---|
| Deoxycholic Acid Disulfate SCHEMBL27095059 | 0.91 | VDR (0.80) | GPBAR1NR1H4SLC10A2TBXA2RPDE3A | |
| Deoxycholic Acid Disulfate SCHEMBL19199088 | 0.91 | VDR (0.80) | GPBAR1NR1H4SLC10A2TBXA2RPDE3A | |
| Deoxycholic Acid Disulfate SCHEMBL19198992 | 0.91 | VDR (0.80) | GPBAR1NR1H4SLC10A2TBXA2RPDE3A | |
| SCHEMBL10084963 | 0.90 | GPBAR1 (0.79) | GPBAR1NR1H4SLC10A2TBXA2RPDE3A | |
| Lagodeoxycholate SCHEMBL19549579 | 0.88 | GPBAR1 (0.93) | GPBAR1NR1H4SLC10A2TBXA2RPDE3A | |
| SCHEMBL22034234 | 0.87 | GPBAR1 (0.75) | GPBAR1NR1H4SLC10A2PDE3AUSP2 | |
| SCHEMBL22034176 | 0.86 | GPBAR1 (0.64) | GPBAR1NR1H4SLC10A2PDE3ATDP1 | |
| SCHEMBL16728362 | 0.86 | GPBAR1 (0.73) | GPBAR1NR1H4SLC10A2TBXA2RPDE3A | |
| Lagodeoxycholate SCHEMBL24001452 | 0.86 | GPBAR1 (1.00) | GPBAR1NR1H4SLC10A2TBXA2RPDE3A | |
| Lagodeoxycholate SCHEMBL22778334 | 0.86 | GPBAR1 (1.00) | GPBAR1NR1H4SLC10A2TBXA2RPDE3A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021072322-A1 | TREATMENT FOR GASTROINTESTINAL DISORDERS | MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) | 2021-04-15 | — | — | WO | disclosed |