Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | COMT | P21964 | 1/20 | 0.31 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10445655 | 0.84 | CYP1A2 (0.41) | CYP1A2CYP2D6CYP2C19TSHRCOMT | |
| SCHEMBL30054804 | 0.81 | LMNA (0.42) | HTTPOLBKMT2AL3MBTL1MAPK1 | |
| SCHEMBL19026752 | 0.76 | — | — | |
| SCHEMBL15200529 | 0.74 | — | — | |
| SCHEMBL23489743 | 0.74 | — | — | |
| SCHEMBL15199512 | 0.71 | ALDH1A1 (0.35) | HTTPOLBKMT2AL3MBTL1MAPK1 | |
| SCHEMBL18480093 | 0.70 | CARM1 (0.35) | NPC1CYP1A2CYP2D6CYP2C19RAB9A | |
| SCHEMBL25465246 | 0.68 | CYP1A2 (0.35) | POLBKMT2AL3MBTL1MAPK1CYP1A2 | |
| SCHEMBL25464825 | 0.68 | CYP1A2 (0.35) | HTTPOLBKMT2AL3MBTL1MAPK1 | |
| SCHEMBL2788882 | 0.68 | KDM4E (0.50) | HTTPOLBTSHRSMN1; SMN2 |
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-116635076-A | Macrocyclic compounds and uses thereof | 荣山医药股份有限公司 | 2023-08-22 | — | — | CN | disclosed |