Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL11413915 | 0.84 | SLC6A4 (0.34) | HTT | |
| SCHEMBL19044550 | 0.81 | SIGMAR1 (0.36) | SIGMAR1CHRM5CHRM3ALDH1A1HTT | |
| SCHEMBL1088109 | 0.80 | SIGMAR1 (0.42) | SIGMAR1CHRM5CHRM3ALDH1A1HTT | |
| Hydrochloric Acid SCHEMBL571818 | 0.78 | SIGMAR1 (0.41) | SIGMAR1CHRM5CHRM3ALDH1A1HTT | |
| SCHEMBL14614393 | 0.78 | SIGMAR1 (0.37) | SIGMAR1CHRM5CHRM3ALDH1A1HTT | |
| Hydrochloric Acid SCHEMBL572488 | 0.78 | SIGMAR1 (0.41) | SIGMAR1CHRM5CHRM3ALDH1A1HTT | |
| Hydrochloric Acid SCHEMBL28284212 | 0.78 | ATM (0.30) | — | |
| SCHEMBL4586800 | 0.75 | SIGMAR1 (0.35) | SIGMAR1CHRM5CHRM3ALDH1A1HTT | |
| SCHEMBL9434047 | 0.75 | SIGMAR1 (0.39) | SIGMAR1CHRM5CHRM3ALDH1A1HTT | |
| SCHEMBL1104721 | 0.75 | SIGMAR1 (0.44) | SIGMAR1CHRM5CHRM3ALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-6930111-B2 | Substituted heterocyclic compounds | CV THERAPEUTICS, INC. (US) | 2005-08-16 | — | — | US | disclosed |