Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 15/20 | 0.38 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.36 |
| ▸ | SELE | P16581 | 1/20 | 0.36 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3548936 | 0.81 | MAPT (0.42) | GRM5ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL30079868 | 0.80 | GRM5 (0.42) | GRM5 | |
| SCHEMBL3547873 | 0.75 | SMN1; SMN2 (0.42) | ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL5206947 | 0.75 | IDO1 (0.46) | ICAM1SELEALDH1A1LMNAMAPT | |
| SCHEMBL3554448 | 0.73 | MAPT (0.49) | ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL11068614 | 0.71 | KDM4E (0.49) | ICAM1SELEALDH1A1LMNAMAPT | |
| SCHEMBL22275607 | 0.70 | CDK4 (0.34) | GRM5 | |
| SCHEMBL22275392 | 0.70 | KDM4C (0.37) | — | |
| SCHEMBL20400267 | 0.69 | MEN1 (0.45) | GRM5ALDH1A1SMN1; SMN2 | |
| SCHEMBL9519331 | 0.68 | ALDH1A1 (0.56) | ALDH1A1LMNAMAPTSMN1; 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-112204036-B | Macrocyclic fused pyrazoles as MCL-1 inhibitors | 苏州亚盛药业有限公司 | 2022-12-27 | — | — | CN | disclosed |