Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.46 |
| ▸ | ACACB | O00763 | 1/20 | 0.44 |
| ▸ | ACACA | Q13085 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 9/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 4/20 | 0.35 |
| ▸ | TTR | P02766 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9180437 | 0.82 | ACLY (0.47) | ACLYACACBACACATSHRCYP2D6 | |
| SCHEMBL9182802 | 0.82 | ACLY (0.47) | ACLYACACBACACATSHRCYP2D6 | |
| SCHEMBL7216560 | 0.81 | ACLY (0.54) | ACLYACACBACACATSHRPPARA | |
| SCHEMBL127297 | 0.80 | — | — | |
| SCHEMBL2784372 | 0.80 | ACLY (0.62) | ACLYACACBACACATSHRCYP2D6 | |
| SCHEMBL7222110 | 0.79 | ACLY (0.48) | ACLYACACBACACATSHRCYP2D6 | |
| SCHEMBL10578419 | 0.78 | ACLY (0.44) | ACLYACACBACACATSHRCYP2D6 | |
| Ammonia Solution, Strong SCHEMBL9181421 | 0.78 | ACLY (0.60) | ACLYACACBACACATSHRCYP2D6 | |
| SCHEMBL4459366 | 0.78 | ACLY (0.60) | ACLYACACBACACATSHRCYP2D6 | |
| SCHEMBL27359290 | 0.78 | ACLY (0.60) | ACLYACACBACACATSHRCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101374844-A | Pyrrolopyridazinone compound | UBE INDUSTRIES (JP) | 2009-02-25 | — | — | CN | disclosed |