Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | CALCRL | Q16602 | 14/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22869851 | 1.00 | ALDH1A1 (0.46) | ALDH1A1DRD2CALCRLLMNAMAPK1 | |
| SCHEMBL22869847 | 0.92 | ALDH1A1 (0.42) | ALDH1A1DRD2CALCRLLMNAMAPK1 | |
| SCHEMBL30870195 | 0.92 | ALDH1A1 (0.42) | ALDH1A1DRD2CALCRLLMNAMAPK1 | |
| SCHEMBL22869407 | 0.89 | ALDH1A1 (0.40) | ALDH1A1DRD2CALCRLLMNAMAPK1 | |
| SCHEMBL30870571 | 0.89 | ALDH1A1 (0.40) | ALDH1A1DRD2CALCRLLMNAMAPK1 | |
| SCHEMBL27207701 | 0.89 | ALDH1A1 (0.44) | ALDH1A1DRD2CALCRLLMNAMAPK1 | |
| SCHEMBL22869702 | 0.89 | ALDH1A1 (0.46) | ALDH1A1DRD2CALCRLLMNACHRM1 | |
| SCHEMBL30870351 | 0.89 | ALDH1A1 (0.46) | ALDH1A1DRD2CALCRLLMNACHRM1 | |
| SCHEMBL29198167 | 0.89 | ALDH1A1 (0.49) | ALDH1A1DRD2CALCRLLMNAMAPK1 | |
| Trifluoroacetic Acid SCHEMBL29198274 | 0.87 | DRD2 (0.40) | ALDH1A1DRD2CALCRLLMNAMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112074511-B | Substituted benzodiazoles and their use in therapy | 托马斯·黑勒戴药物研究基金会 | 2024-04-26 | — | — | CN | claimed |
| CN-112074511-B | Substituted benzodiazoles and their use in therapy | 托马斯·黑勒戴药物研究基金会 | 2024-04-26 | — | — | CN | disclosed |