Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.51 |
| ▸ | NAMPT | P43490 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 5/20 | 0.36 |
| ▸ | MET | P08581 | 2/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 4/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6552886 | 0.87 | HTR2A (0.48) | HTR2AKCNH2CA1METCA12 | |
| SCHEMBL6683308 | 0.84 | CA1 (0.47) | CA1METTYRCA12CA4 | |
| SCHEMBL6540434 | 0.76 | HTR2A (0.52) | HTR2AKCNH2NAMPTCA1CA12 | |
| SCHEMBL8758151 | 0.76 | MET (0.56) | CA1METTYRCA12CA4 | |
| SCHEMBL6683181 | 0.74 | GAA (0.50) | CA1CA12CA7CA9CA2 | |
| SCHEMBL6676148 | 0.72 | AKR1B10 (0.45) | CA1METTYRCA12CA4 | |
| SCHEMBL6681976 | 0.71 | MET (0.48) | CA1METTYRCA12CA4 | |
| SCHEMBL27584202 | 0.70 | CA2 (0.64) | CA1CA12CA4CA6CA5A | |
| SCHEMBL28538352 | 0.69 | F2 (0.56) | CA1CA12CA4CA6CA5A | |
| SCHEMBL6554323 | 0.69 | POLB (0.52) | HTR2AKCNH2NAMPTCA1CA12 |
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 |