Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 3/20 | 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL7386453 | 0.96 | AGTR2 (0.54) | AGTR2ALDH1A1POLBSMN1; SMN2KMT2A | |
| Acetic Acid SCHEMBL7386447 | 0.96 | AGTR2 (0.54) | AGTR2ALDH1A1POLBSMN1; SMN2KMT2A | |
| SCHEMBL30743851 | 0.89 | AGTR2 (0.52) | AGTR2ALDH1A1POLBSMN1; SMN2KMT2A | |
| SCHEMBL7386450 | 0.83 | AGTR2 (0.47) | AGTR2ALDH1A1POLBSMN1; SMN2KMT2A | |
| SCHEMBL27799875 | 0.78 | SIGMAR1 (0.58) | ALDH1A1POLBL3MBTL1 | |
| SCHEMBL7388960 | 0.77 | ALDH1A1 (0.61) | AGTR2ALDH1A1POLBSMN1; SMN2KMT2A | |
| Toluene SCHEMBL3090911 | 0.75 | MAPT (0.39) | SMN1; SMN2 | |
| SCHEMBL7467929 | 0.74 | ALDH1A1 (0.77) | AGTR2ALDH1A1POLBSMN1; SMN2KMT2A | |
| SCHEMBL29017587 | 0.74 | AGTR2 (0.45) | AGTR2ALDH1A1POLBSMN1; SMN2KMT2A | |
| SCHEMBL3516084 | 0.74 | AGTR2 (1.00) | AGTR2TACR1 |
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-111902401-B | Receptor inhibitors, pharmaceutical compositions comprising the same and uses thereof | 北京泰德制药股份有限公司 | 2023-06-13 | — | — | CN | disclosed |