Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.51 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.48 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | TOP2A | P11388 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.45 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19849665 | 0.86 | CA12 (0.45) | SLC6A3SLC6A4SLC6A2MEN1KMT2A | |
| SCHEMBL16720432 | 0.82 | SLC6A3 (0.49) | SLC6A3SLC6A4ALDH1A1HPGDGAA | |
| SCHEMBL16911507 | 0.82 | HNF4A (0.58) | ALDH1A1MEN1MAPTKMT2ALMNA | |
| SCHEMBL17799572 | 0.81 | HNF4A (0.56) | ALDH1A1MEN1MAPTKMT2ALMNA | |
| SCHEMBL27843639 | 0.80 | SLC6A3 (0.74) | SLC6A3SLC6A4ALDH1A1GAAPDCD1 | |
| SCHEMBL1775832 | 0.80 | SLC6A3 (0.74) | SLC6A3SLC6A4ALDH1A1GAAPDCD1 | |
| SCHEMBL9285511 | 0.80 | HNF4A (0.46) | ALDH1A1PDCD1CD274MEN1KMT2A | |
| Bicarbonate SCHEMBL27467504 | 0.79 | SLC6A3 (0.72) | SLC6A3SLC6A4ALDH1A1GAAPDCD1 | |
| Phosphine SCHEMBL11469830 | 0.79 | SLC6A3 (0.72) | SLC6A3SLC6A4ALDH1A1GAAPDCD1 | |
| SCHEMBL17799575 | 0.78 | IKBKB (0.46) | ALDH1A1HPGDPDCD1CD274MEN1 |
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-2021043116-A1 | BIPHENYL COMPOUNDS, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 中国药科大学 | 2021-03-11 | — | — | WO | disclosed |