Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C4 | P17516 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | SLC6A12 | P48065 | 3/20 | 0.33 |
| ▸ | SLC6A11 | P48066 | 3/20 | 0.33 |
| ▸ | SLC6A13 | Q9NSD5 | 3/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 2/20 | 0.30 |
| ▸ | CA1 | P00915 | 2/20 | 0.30 |
| ▸ | CA2 | P00918 | 2/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5506589 | 0.77 | SLC6A12 (0.36) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| SCHEMBL13849730 | 0.66 | AKR1C4 (0.39) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| SCHEMBL4099629 | 0.66 | AKR1C4 (0.39) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| SCHEMBL13849728 | 0.66 | ALDH1A1 (0.40) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| SCHEMBL4103087 | 0.66 | AKR1C4 (0.39) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| SCHEMBL11754424 | 0.63 | AKR1C4 (0.47) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| SCHEMBL22804147 | 0.62 | AKR1C4 (0.53) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| SCHEMBL14035897 | 0.62 | AKR1C4 (0.53) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| SCHEMBL10780374 | 0.62 | AKR1C4 (0.35) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 | |
| SCHEMBL9278180 | 0.61 | SLC6A12 (0.57) | AKR1C4AKR1C3AKR1C2SLC6A12SLC6A11 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1856044-A2 | PYRROLE DERIVATIVES AS DNA GYRASE AND TOPOISOMERASE INHIBITORS | AstraZeneca AB (SE) | 2007-11-21 | — | — | EP | disclosed |
| WO-2006087548-A2 | PYRROLE DERIVATIVES AS DNA GYRASE AND TOPOISOMERASE INHIBITORS | ASTRAZENECA AB (SE) | 2006-08-24 | — | — | WO | disclosed |