Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP7 | P09237 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL538525 | 0.74 | DPP4 (0.31) | — | |
| SCHEMBL6989956 | 0.71 | KDM4E (0.32) | — | |
| SCHEMBL8419841 | 0.71 | CYP2D6 (0.47) | — | |
| SCHEMBL27497313 | 0.71 | CHRNB2 (0.31) | MMP1MMP3MMP7MMP9MMP13 | |
| Water SCHEMBL7778613 | 0.70 | CYP2D6 (0.46) | — | |
| SCHEMBL12108456 | 0.69 | TSHR (0.33) | MMP1MMP3MMP7MMP9MMP13 | |
| SCHEMBL8498877 | 0.68 | HTR2A (0.32) | — | |
| SCHEMBL6428865 | 0.68 | KDM4E (0.31) | — | |
| SCHEMBL7527236 | 0.67 | CHRNB2 (0.35) | MMP1MMP3MMP7MMP9MMP13 | |
| SCHEMBL7108631 | 0.67 | SLC6A1 (0.32) | — |
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-6191273-B1 | 3,6,10,14-SUBSTITUTED-3,6,10,16-TETRAAZABICYCLO(10.3.1)-HEXADE CA-1(16),12,14-TRIENE COMPOUNDS OF GIVEN FORMULA; ANTIBACTERIAL AND OTHER UTILITIES, SUCH AS TO SCREEN FOR PESTICIDES OR DRUGS | ISIS PHARMACEUTICALS, INC. | 2001-02-20 | — | — | US | disclosed |