Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 1/20 | 0.61 |
| ▸ | HPGDS | O60760 | 4/20 | 0.58 |
| ▸ | RXRA | P19793 | 1/20 | 0.58 |
| ▸ | RXRB | P28702 | 1/20 | 0.58 |
| ▸ | P2RY12 | Q9H244 | 3/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.48 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.48 |
| ▸ | F2 | P00734 | 1/20 | 0.48 |
| ▸ | F10 | P00742 | 1/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.48 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.48 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.46 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2246912 | 0.90 | MMP12 (0.58) | MMP12HPGDSP2RY12CA12CA1 | |
| SCHEMBL2246549 | 0.87 | RXRA (0.58) | MMP12RXRARXRBCA1F2 | |
| SCHEMBL3589769 | 0.84 | KLKB1 (0.62) | MMP12RXRARXRBP2RY12ADAMTS4 | |
| SCHEMBL2250713 | 0.83 | MMP12 (0.54) | MMP12HPGDSFFAR1 | |
| SCHEMBL2246054 | 0.83 | MMP12 (0.76) | MMP12HPGDSCA12CA1CA9 | |
| SCHEMBL2245321 | 0.83 | MMP12 (0.76) | MMP12HPGDSCA12CA1CA9 | |
| SCHEMBL2243866 | 0.82 | C3AR1 (0.67) | MMP12HPGDSPRSS1C3AR1 | |
| SCHEMBL2249755 | 0.82 | ADAMTS5 (0.68) | MMP12RXRARXRBP2RY12ADAMTS4 | |
| SCHEMBL2244785 | 0.81 | CA12 (0.56) | MMP12HPGDSCA12CA1CA9 | |
| SCHEMBL2246121 | 0.81 | CA12 (0.56) | MMP12HPGDSCA12CA1CA9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7998965-B2 | Glutamate aggrecanase inhibitors | WYETH LLC (US) | 2011-08-16 | — | — | US | disclosed |