Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 4/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.52 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.52 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.49 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.49 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.49 |
| ▸ | MIF | P14174 | 3/20 | 0.48 |
| ▸ | TNKS | O95271 | 1/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | CD74 | P04233 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL804740 | 0.94 | ADRA1D (0.50) | ADRA1DADRA1AADRA1BCHRM4CHRM5 | |
| SCHEMBL8065109 | 0.90 | ADRA1D (0.48) | ADRA1DADRA1AADRA1BCHRM4CHRM5 | |
| SCHEMBL13341124 | 0.80 | TNKS (0.44) | ADRA1DADRA1AADRA1BCHRM4CHRM5 | |
| SCHEMBL13450009 | 0.78 | HTR2A (0.48) | ADRA1DADRA1AADRA1BCHRM4CHRM5 | |
| SCHEMBL8672170 | 0.78 | CHRM2 (0.56) | ADRA1DADRA1AADRA1BCHRM4CHRM5 | |
| SCHEMBL21106830 | 0.77 | CRBN (0.48) | CHRM2 | |
| SCHEMBL21107130 | 0.77 | CRBN (0.48) | CHRM2 | |
| SCHEMBL21106902 | 0.77 | CRBN (0.48) | CHRM2 | |
| SCHEMBL20117054 | 0.75 | CHRM2 (0.53) | ADRA1DADRA1AADRA1BCHRM4CHRM5 | |
| SCHEMBL805919 | 0.75 | ADRA1D (0.52) | ADRA1DADRA1AADRA1BCHRM4CHRM5 |
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 |
|---|---|---|---|---|---|---|---|
| US-8993585-B2 | Cyclic amine substituted pyrimidinediamines as PKC inhibitors | RIGEL PHARMACEUTICALS, INC. (US) | 2015-03-31 | — | — | US | disclosed |