Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 5/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | HCAR1 | Q9BXC0 | 4/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL498054 | 0.77 | KCNN4 (0.42) | KCNN4HSD11B1HCAR1SCN9AALDH1A1 | |
| SCHEMBL498090 | 0.73 | SLC5A1 (0.46) | KCNN4HCAR1SCN9AALDH1A1HSD17B10 | |
| SCHEMBL28460135 | 0.69 | KCNN4 (0.52) | KCNN4HSD11B1HCAR1SCN9AALDH1A1 | |
| SCHEMBL1493544 | 0.69 | KCNN4 (0.52) | KCNN4HSD11B1HCAR1SCN9AALDH1A1 | |
| SCHEMBL497639 | 0.67 | KCNN4 (0.40) | KCNN4HSD11B1HCAR1SCN9AALDH1A1 | |
| SCHEMBL14996565 | 0.67 | MAPT (0.47) | KCNN4HSD11B1HCAR1SCN9AALDH1A1 | |
| SCHEMBL28188336 | 0.67 | KCNN4 (0.47) | KCNN4HSD11B1HCAR1SCN9AALDH1A1 | |
| SCHEMBL4205517 | 0.66 | KCNN4 (0.56) | KCNN4ALDH1A1TSHRHTTHSD17B10 | |
| SCHEMBL12859430 | 0.65 | SCN9A (0.43) | KCNN4HSD11B1HCAR1SCN9AALDH1A1 | |
| SCHEMBL5906114 | 0.65 | HCAR1 (0.47) | KCNN4HCAR1SCN9AP2RX7 |
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-101448798-A | Compounds and methods for modulating FXR | LILLY CO ELI (US) | 2009-06-03 | — | — | CN | disclosed |