Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 8/20 | 0.35 |
| ▸ | IDO1 | P14902 | 7/20 | 0.35 |
| ▸ | HRH2 | P25021 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | CALCRL | Q16602 | 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 | |
|---|---|---|---|---|
| SCHEMBL2429704 | 0.88 | ACACB (0.39) | ACACBCALCRL | |
| SCHEMBL2426873 | 0.87 | ACACB (0.46) | ACACBIDO1 | |
| SCHEMBL4014093 | 0.86 | OPRD1 (0.33) | CTSKHRH2HRH1OPRD1OPRK1 | |
| SCHEMBL2425326 | 0.84 | TACR1 (0.43) | — | |
| SCHEMBL3928319 | 0.83 | CTSK (0.35) | CTSKACACBIDO1HRH2HRH1 | |
| SCHEMBL2424220 | 0.82 | ACACB (0.39) | CTSKACACBCALCRL | |
| SCHEMBL12290420 | 0.81 | ACACB (0.46) | ACACBIDO1 | |
| SCHEMBL2430403 | 0.80 | TACR1 (0.39) | — | |
| SCHEMBL4014639 | 0.80 | CTSK (0.35) | CTSKHRH2HRH1OPRD1OPRK1 | |
| SCHEMBL2431280 | 0.80 | ACACB (0.37) | CTSKACACB |
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-2009009411-A1 | SUBSTITUTED HETEROCYCLIC ETHERS AND THEIR USE IN CNS DISORDERS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-01-15 | — | — | WO | disclosed |