Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.37 |
| ▸ | ACACB | O00763 | 7/20 | 0.37 |
| ▸ | NAMPT | P43490 | 8/20 | 0.36 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.33 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.33 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.33 |
| ▸ | KCNJ8 | Q15842 | 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 | |
|---|---|---|---|---|
| SCHEMBL6553980 | 0.90 | ESR1 (0.40) | ESR1KCNH2CNR1ACACBABCC9 | |
| SCHEMBL6552876 | 0.90 | ESR1 (0.39) | ESR1KCNH2CNR1ACACBNAMPT | |
| SCHEMBL6540840 | 0.88 | NAMPT (0.45) | CNR1ACACBNAMPT | |
| SCHEMBL6554555 | 0.86 | ACACB (0.45) | ESR1KCNH2CNR1ACACB | |
| SCHEMBL6541730 | 0.85 | CNR1 (0.38) | ESR1KCNH2CNR1ACACBNAMPT | |
| SCHEMBL6552529 | 0.84 | ABCC9 (0.44) | ESR1KCNH2CNR1ACACBNAMPT | |
| SCHEMBL6541794 | 0.84 | PTPN1 (0.44) | CNR1ACACBNAMPT | |
| SCHEMBL6540415 | 0.82 | CNR1 (0.40) | ESR1KCNH2CNR1ACACBABCC9 | |
| SCHEMBL6553965 | 0.82 | NAMPT (0.37) | NAMPT | |
| SCHEMBL6553983 | 0.82 | KMT2A (0.43) | ESR1KCNH2CNR1ACACBABCC9 |
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-1389185-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-02-18 | — | — | EP | disclosed |
| WO-2002094770-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-11-28 | — | — | WO | disclosed |