Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP3 | P08254 | 7/20 | 0.46 |
| ▸ | MMP9 | P14780 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 9/20 | 0.42 |
| ▸ | MMP1 | P03956 | 5/20 | 0.42 |
| ▸ | TLR2 | O60603 | 1/20 | 0.42 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.42 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10936873 | 0.77 | EPHX2 (0.56) | CNR2CSNK1EPOLBTLR2 | |
| SCHEMBL10936823 | 0.77 | EPHX2 (0.56) | CNR2CSNK1EPOLBTLR2 | |
| SCHEMBL10936440 | 0.77 | EPHX2 (0.56) | CNR2CSNK1EPOLBTLR2 | |
| SCHEMBL25415614 | 0.76 | MMP8 (0.55) | CYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL30444595 | 0.76 | S1PR2 (0.50) | MMP3CNR2CSNK1EMMP2MMP1 | |
| SCHEMBL27029539 | 0.76 | S1PR2 (0.50) | MMP3CNR2CSNK1EMMP2MMP1 | |
| SCHEMBL8509501 | 0.76 | MMP8 (0.56) | MMP3MMP9CNR2POLBMMP2 | |
| SCHEMBL10939549 | 0.76 | EPHX2 (0.54) | CNR2POLBTLR2 | |
| SCHEMBL16194597 | 0.76 | CSNK1E (0.52) | MMP3CNR2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL16194598 | 0.76 | CSNK1E (0.52) | MMP3CNR2CYP1A2CYP2C9CYP2C19 |
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-1009736-A1 | MALONIC ACID BASED MATRIX METALLOPROTEINASE INHIBITORS | Roche Diagnostics GmbH (DE) | 2000-06-21 | — | — | EP | disclosed |
| WO-1999011608-A1 | MALONIC ACID BASED MATRIX METALLOPROTEINASE INHIBITORS | ROCHE DIAGNOSTICS GMBH (DE) | 1999-03-11 | — | — | WO | disclosed |