Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | MMP13 | P45452 | 2/20 | 0.46 |
| ▸ | MMP7 | P09237 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | LIPE | Q05469 | 5/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| SCHEMBL13941032 | 0.89 | CYP3A4 (0.56) | CYP3A4MMP13MMP7MAPTDRD2 | |
| SCHEMBL3934572 | 0.88 | MMP13 (0.46) | CYP3A4MMP13MMP7MMP14DRD2 | |
| SCHEMBL13940831 | 0.88 | MMP13 (0.46) | CYP3A4MMP13MMP7MMP14DRD2 | |
| SCHEMBL5883424 | 0.84 | MMP7 (0.53) | CYP3A4MMP13MMP7POLBTP53 | |
| SCHEMBL3936734 | 0.83 | CYP3A4 (0.51) | CYP3A4MMP13MMP7MAPT | |
| SCHEMBL13923651 | 0.83 | MMP13 (0.68) | CYP3A4MMP13MMP7POLBLIPE | |
| SCHEMBL14259940 | 0.80 | CYP3A4 (0.71) | CYP3A4MMP13MMP7MAPT | |
| SCHEMBL8304549 | 0.79 | MMP13 (0.61) | CYP3A4MMP13MMP7LIPETP53 | |
| SCHEMBL6647886 | 0.79 | MMP7 (0.41) | CYP3A4MMP13MMP7TP53MMP14 | |
| SCHEMBL3943167 | 0.77 | CYP3A4 (0.43) | CYP3A4MMP13MMP7POLBTP53 |
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-1644340-B1 | N-[({'4-SUBSTITUTED PIPERAZINE-1-YL}SULFONYLMETHYL)ALKYL]-N-HYDROXYFORMAMIDE COMPOUNDS AS METALLOPROTEINASE INHIBITORS | ASTRAZENECA AB (SE) | 2008-11-12 | — | — | EP | disclosed |
| WO-2005000822-A1 | N-{‘4-SUBSTITUTED PIPERAZINE-1-SULFONYLMETHYL!ALKYL}-N-HYDROXYFOMAMIDE COMPOUNDS AS METALLOPROTEINASE INHIBITORS | ASTRAZENECA AB (SE) | 2005-01-06 | — | — | WO | disclosed |