Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 3/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ABCC9 | O60706 | 5/20 | 0.33 |
| ▸ | ABCC8 | Q09428 | 5/20 | 0.33 |
| ▸ | KCNJ11 | Q14654 | 5/20 | 0.33 |
| ▸ | KCNJ8 | Q15842 | 5/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6679390 | 0.91 | METAP2 (0.42) | CNR1ESR1KCNH2ACACBGAA | |
| SCHEMBL6803630 | 0.88 | CNR1 (0.40) | CNR1ESR1KCNH2ACACBGAA | |
| SCHEMBL6681129 | 0.86 | CNR1 (0.42) | CNR1ESR1KCNH2ACACBGAA | |
| SCHEMBL6687524 | 0.85 | CNR1 (0.40) | CNR1ESR1KCNH2ACACBGAA | |
| SCHEMBL6683086 | 0.84 | CNR1 (0.57) | CNR1ACACBABCC9ABCC8KCNJ11 | |
| SCHEMBL6683466 | 0.82 | CNR1 (0.46) | CNR1ACACB | |
| SCHEMBL6809808 | 0.80 | CNR1 (0.41) | CNR1ESR1KCNH2ACACBGAA | |
| SCHEMBL6681192 | 0.80 | CNR1 (0.40) | CNR1ESR1KCNH2ACACBGAA | |
| SCHEMBL6680778 | 0.80 | CNR1 (0.40) | CNR1ESR1KCNH2ACACBGAA | |
| SCHEMBL6677754 | 0.79 | ALDH1A1 (0.42) | CNR1ESR1KCNH2ACACBGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004045610-A1 | AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA-3 ADRENERGIC RECEPTOR AGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD (JP) | 2004-06-03 | — | — | WO | disclosed |