Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ARG1 | P05089 | 1/20 | 0.36 |
| ▸ | ARG2 | P78540 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3078767 | 0.94 | CYP1A2 (0.43) | CYP1A2HTR6 | |
| SCHEMBL155970 | 0.94 | CYP1A2 (0.43) | CYP1A2HTR6 | |
| SCHEMBL12568590 | 0.86 | CYP1A2 (0.64) | CYP1A2ADRA2AARG1ARG2CHRM5 | |
| SCHEMBL9733679 | 0.86 | CYP1A2 (0.64) | CYP1A2ADRA2AARG1ARG2CHRM5 | |
| SCHEMBL5961386 | 0.84 | CYP1A2 (0.68) | CYP1A2ADRA2AARG1ARG2CHRM5 | |
| SCHEMBL12568584 | 0.84 | CYP1A2 (0.68) | CYP1A2ADRA2AARG1ARG2CHRM5 | |
| SCHEMBL12568588 | 0.84 | CYP1A2 (0.68) | CYP1A2ADRA2AARG1ARG2CHRM5 | |
| SCHEMBL9927939 | 0.84 | CYP1A2 (0.68) | CYP1A2ADRA2AARG1ARG2CHRM5 | |
| SCHEMBL15314551 | 0.84 | CYP1A2 (0.62) | CYP1A2ADRA2AARG1ARG2CHRM5 | |
| SCHEMBL13162440 | 0.84 | CYP1A2 (0.73) | CYP1A2ADRA2ATP53HTR6 |
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 |
|---|---|---|---|---|---|---|---|
| US-8304547-B2 | Azolecarboxamide compound or salt thereof | ASTELLAS PHARMA INC. (JP) | 2012-11-06 | — | — | US | disclosed |
| US-8304547-B2 | Azolecarboxamide compound or salt thereof | ASTELLAS PHARMA INC. (JP) | 2012-11-06 | — | — | US | disclosed |