Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 5/20 | 0.48 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 3/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6700025 | 0.90 | MMP13 (0.45) | MMP13EGLN1POLBLMNATP53 | |
| SCHEMBL6177868 | 0.90 | LMNA (0.50) | MMP13POLBALDH1A1LMNATP53 | |
| SCHEMBL6697229 | 0.90 | LMNA (0.51) | POLBALDH1A1LMNAGAAMEN1 | |
| SCHEMBL6179234 | 0.88 | MMP13 (0.60) | MMP13POLBLMNATP53RXFP1 | |
| SCHEMBL6174508 | 0.86 | MMP13 (0.59) | MMP13EGLN1POLBALDH1A1NPC1 | |
| SCHEMBL6168393 | 0.83 | LMNA (0.46) | MMP13POLBALDH1A1RAB9ALMNA | |
| SCHEMBL6704286 | 0.82 | EPHX2 (0.44) | MMP13EGLN1ALDH1A1LMNAHDAC3 | |
| SCHEMBL5697046 | 0.79 | SIRT2 (0.39) | EGLN1LMNAHDAC3HDAC1HDAC2 | |
| SCHEMBL5697085 | 0.79 | PSMB1 (0.46) | EGLN1ALDH1A1LMNAHDAC3HDAC1 | |
| SCHEMBL6363015 | 0.78 | MMP13 (0.77) | MMP13HDAC3HDAC1HDAC2 |
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-1530472-A1 | ISOQUINOLINE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS | Warner-Lambert Company LLC (US) | 2005-05-18 | — | — | EP | disclosed |
| WO-2004014379-A1 | ISOQUINOLINE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |