Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MME | P08473 | 1/20 | 0.40 |
| ▸ | MMEL1 | Q495T6 | 1/20 | 0.40 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 3/20 | 0.38 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.38 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
| ▸ | ABCC9 | O60706 | 3/20 | 0.38 |
| ▸ | ABCC8 | Q09428 | 3/20 | 0.38 |
| ▸ | KCNJ11 | Q14654 | 3/20 | 0.38 |
| ▸ | KCNJ8 | Q15842 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6805111 | 0.88 | ACACB (0.48) | ESR1KCNH2ACACB | |
| SCHEMBL6677082 | 0.85 | ACACB (0.50) | ESR1KCNH2L3MBTL1ACACB | |
| SCHEMBL6676495 | 0.84 | ALDH1A1 (0.47) | L3MBTL1ACACB | |
| SCHEMBL6805115 | 0.84 | APAF1 (0.37) | ESR1KCNH2MMEMMEL1CDK2 | |
| SCHEMBL6540275 | 0.83 | ABCC9 (0.55) | ESR1KCNH2ABCC9ABCC8KCNJ11 | |
| SCHEMBL6805113 | 0.82 | SYK (0.43) | ESR1KCNH2CDK2ITGB1ITGA4 | |
| SCHEMBL6540336 | 0.81 | ACACB (0.52) | ESR1KCNH2ABCC9ABCC8KCNJ11 | |
| SCHEMBL6809925 | 0.81 | CNR1 (0.38) | ESR1KCNH2MMEMMEL1ABCC9 | |
| SCHEMBL6799811 | 0.81 | ABCC9 (0.45) | ESR1KCNH2ABCC9ABCC8KCNJ11 | |
| SCHEMBL6540797 | 0.81 | ABCC9 (0.45) | ESR1KCNH2ABCC9ABCC8KCNJ11 |
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 |