Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.39 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.39 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28936508 | 0.89 | ALDH1A1 (0.48) | ALDH1A1LMNATSHRCHRM5CHRM1 | |
| SCHEMBL5000049 | 0.85 | ALOX15 (0.46) | ALDH1A1LMNATSHRCHRM5CHRM1 | |
| SCHEMBL28159744 | 0.83 | ALDH1A1 (0.56) | ALDH1A1LMNATSHRCHRM5CHRM1 | |
| SCHEMBL11728433 | 0.82 | ALDH1A1 (0.59) | ALDH1A1LMNATSHRCHRM5CHRM1 | |
| SCHEMBL10061648 | 0.82 | ALDH1A1 (0.48) | ALDH1A1LMNATSHRCHRM5CHRM1 | |
| SCHEMBL9746891 | 0.80 | ALDH1A1 (0.47) | ALDH1A1LMNATSHRCHRM5CHRM1 | |
| SCHEMBL10399606 | 0.80 | TSHR (0.61) | ALDH1A1LMNATSHRCYP3A4 | |
| SCHEMBL189930 | 0.79 | ALDH1A1 (0.74) | ALDH1A1LMNATSHRCHRM5CHRM1 | |
| SCHEMBL29403528 | 0.79 | ALDH1A1 (0.50) | ALDH1A1LMNATSHRSMN1; SMN2HSD17B10 | |
| SCHEMBL410091 | 0.78 | ALDH1A1 (0.54) | ALDH1A1LMNATSHRCHRM5CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2124549-A1 | ANTI-HYPERCHOLESTEROLEMIC COMPOUNDS | Merck & Co., Inc. (US) | 2009-12-02 | — | — | EP | disclosed |
| WO-2008085300-A1 | ANTI-HYPERCHOLESTEROLEMIC COMPOUNDS | MERCK & CO., INC. (US) | 2008-07-17 | — | — | WO | disclosed |