Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 14/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21043141 | 0.88 | CHRM1 (0.53) | CHRM1ALDH1A1KDM4EMAPK1DRD2 | |
| SCHEMBL21042783 | 0.84 | ALDH1A1 (0.64) | CHRM1ALDH1A1SMN1; SMN2HTTMAPT | |
| SCHEMBL22001279 | 0.83 | CHRM1 (0.46) | CHRM1ALDH1A1KDM4EMAPK1SMN1; SMN2 | |
| SCHEMBL16628324 | 0.83 | CHRM1 (0.68) | CHRM1 | |
| SCHEMBL22001176 | 0.83 | ALDH1A1 (0.48) | CHRM1ALDH1A1MAPK1SMN1; SMN2HTT | |
| SCHEMBL16593312 | 0.82 | CHRM1 (0.56) | CHRM1ALDH1A1KDM4EMAPK1DRD2 | |
| SCHEMBL21043133 | 0.82 | SMN1; SMN2 (0.50) | CHRM1ALDH1A1SMN1; SMN2HTTMAPT | |
| SCHEMBL21043089 | 0.79 | CHRM1 (0.75) | CHRM1 | |
| SCHEMBL21043119 | 0.77 | ALDH1A1 (0.42) | CHRM1ALDH1A1KDM4ESMN1; SMN2HTT | |
| SCHEMBL16593341 | 0.77 | CHRM1 (0.73) | CHRM1KDM4ESMN1; SMN2HTTMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3489237-B1 | 4-AZAINDOLE DERIVATIVES | EISAI R&D MAN CO LTD (JP) | 2020-05-13 | — | — | EP | disclosed |