Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 3/20 | 0.41 |
| ▸ | KIFC1 | Q9BW19 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.32 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.32 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.32 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14258959 | 0.95 | ADORA1 (0.41) | ADORA1KIFC1CHRM1OPRM1OPRK1 | |
| SCHEMBL14259095 | 0.93 | ADORA1 (0.42) | ADORA1KIFC1CHRM1OPRM1OPRK1 | |
| SCHEMBL14258954 | 0.92 | ADORA1 (0.39) | ADORA1KIFC1CHRM1OPRM1OPRK1 | |
| SCHEMBL14258951 | 0.90 | HRH2 (0.37) | ADORA1KIFC1CHRM1OPRM1OPRK1 | |
| SCHEMBL14259082 | 0.88 | ADORA1 (0.41) | ADORA1KIFC1CHRM1OPRM1OPRK1 | |
| SCHEMBL14258972 | 0.86 | CHRM1 (0.36) | ADORA1KIFC1CHRM1OPRM1OPRK1 | |
| SCHEMBL14259084 | 0.86 | ADORA1 (0.39) | ADORA1KIFC1CHRM1OPRM1OPRK1 | |
| SCHEMBL14258953 | 0.86 | ADORA1 (0.38) | ADORA1KIFC1CHRM1OPRM1OPRK1 | |
| SCHEMBL13713104 | 0.85 | HRH2 (0.36) | ADORA1KIFC1CHRM1OPRM1OPRK1 | |
| SCHEMBL14259086 | 0.85 | ADORA3 (0.39) | ADORA1KIFC1CHRM1OPRM1OPRK1 |
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-2008027075-A2 | SULFHYDRYL-REACTIVE, WATER SOLUBLE DYES | THE SCRIPPS RESEARCH INSTITUTE (US) | 2008-03-06 | — | — | WO | disclosed |