Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.40 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 9/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ECE1 | P42892 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | RRM1 | P23921 | 1/20 | 0.37 |
| ▸ | CASP2 | P42575 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1045359 | 0.98 | EPHX1 (0.42) | NOD1DPP7EPHX1ALOX15RRM1 | |
| SCHEMBL29697582 | 0.98 | EPHX1 (0.42) | NOD1DPP7EPHX1ALOX15RRM1 | |
| SCHEMBL29364715 | 0.98 | EPHX1 (0.42) | NOD1DPP7EPHX1ALOX15RRM1 | |
| SCHEMBL2692730 | 0.98 | EPHX1 (0.42) | NOD1DPP7EPHX1ALOX15RRM1 | |
| SCHEMBL1045358 | 0.98 | EPHX1 (0.42) | NOD1DPP7EPHX1ALOX15RRM1 | |
| SCHEMBL23831532 | 0.98 | EPHX1 (0.42) | NOD1DPP7EPHX1ALOX15RRM1 | |
| SCHEMBL29697562 | 0.94 | ALOX15 (0.44) | NOD1DPP7EPHX1ALOX15ECE1 | |
| SCHEMBL4285744 | 0.87 | NOD1 (0.48) | NOD1DPP7EPHX1ALOX15ECE1 | |
| SCHEMBL4285748 | 0.87 | NOD1 (0.48) | NOD1DPP7EPHX1ALOX15ECE1 | |
| SCHEMBL3261071 | 0.86 | ECE1 (0.40) | ALOX15ECE1CA1CA2 |
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-1005448-A2 | NOVEL INHIBITORS OF AGGRECANASE AND MATRIX METALLOPROTEINASES FOR THE TREATMENT OF ARTHRITIS | Du Pont Pharmaceuticals Company (US) | 2000-06-07 | — | — | EP | disclosed |
| WO-1999009000-A2 | NOVEL INHIBITORS OF AGGRECANASE AND MATRIX METALLOPROTEINASES FOR THE TREATMENT OF ARTHRITIS | DU PONT PHARMACEUTICALS COMPANY (US) | 1999-02-25 | — | — | WO | disclosed |