Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.41 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.41 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 6/20 | 0.39 |
| ▸ | GABRD | O14764 | 6/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 6/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 6/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 6/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 6/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 6/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 6/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 6/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 6/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10620304 | 0.84 | TDP1 (0.44) | TDP1CYP3A4ALDH1A1HPGDALOX15 | |
| SCHEMBL9530251 | 0.81 | TDP1 (0.42) | TDP1CYP3A4ALDH1A1HPGDALOX15 | |
| SCHEMBL9527181 | 0.80 | GABRB3 (0.42) | TDP1CYP3A4ALDH1A1HPGDALOX15 | |
| SCHEMBL39558 | 0.80 | ALDH1A1 (0.48) | TDP1CYP3A4ALDH1A1HPGDALOX15 | |
| SCHEMBL9526043 | 0.80 | TDP1 (0.50) | TDP1CYP3A4ALDH1A1HPGDALOX15 | |
| SCHEMBL10772869 | 0.79 | TDP1 (0.44) | TDP1CYP3A4ALDH1A1HPGDALOX15 | |
| SCHEMBL10623513 | 0.78 | LMNA (0.38) | TDP1CYP3A4ALDH1A1HPGDALOX15 | |
| SCHEMBL10347991 | 0.77 | TDP1 (0.48) | TDP1CYP3A4ALDH1A1HPGDALOX15 | |
| SCHEMBL10548001 | 0.77 | TDP1 (0.48) | TDP1CYP3A4ALDH1A1HPGDALOX15 | |
| SCHEMBL10733182 | 0.77 | ALDH1A1 (0.44) | TDP1CYP3A4ALDH1A1HPGDALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0224094-A2 | 1-Aryl-pyrazole | BAYER AG (DE) | 1987-06-03 | — | — | EP | disclosed |