Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.61 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.61 |
| ▸ | AR | P10275 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11302589 | 1.00 | GAA (0.61) | GAARCE1ARMAPTLMNA | |
| SCHEMBL29833731 | 0.96 | GAA (0.55) | GAARCE1ARMAPTLMNA | |
| SCHEMBL19631170 | 0.90 | GAA (0.50) | GAARCE1ARMAPTLMNA | |
| Acetic Acid SCHEMBL28895125 | 0.90 | GAA (0.51) | GAARCE1ARMAPTCYP1A2 | |
| SCHEMBL8469481 | 0.84 | GAA (0.53) | GAARCE1ARMAPTLMNA | |
| SCHEMBL29024081 | 0.83 | CA2 (0.54) | GAAARMAPTLMNAHTT | |
| SCHEMBL8969033 | 0.81 | AR (0.49) | GAAARMAPTLMNACA1 | |
| SCHEMBL9344917 | 0.81 | TSHR (0.52) | GAAARMAPTLMNAHTT | |
| SCHEMBL11214170 | 0.79 | GAA (0.51) | GAARCE1MAPTLMNAHTT | |
| SCHEMBL554296 | 0.78 | GAA (0.70) | GAARCE1MAPTLMNAHTT |
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-115052869-A | Substituted thiophenecarboxamides and derivatives thereof | 拜耳公司 | 2022-09-13 | — | — | CN | disclosed |