Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14889661 | 1.00 | CHRNB2 (0.39) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL3255342 | 0.78 | EPHX1 (0.32) | — | |
| SCHEMBL5093740 | 0.78 | EPHX1 (0.32) | — | |
| SCHEMBL6021282 | 0.78 | EPHX1 (0.32) | — | |
| SCHEMBL17152577 | 0.77 | CA12 (0.36) | — | |
| SCHEMBL17152606 | 0.77 | MMP1 (0.39) | — | |
| SCHEMBL17152493 | 0.76 | MLYCD (0.33) | — | |
| SCHEMBL5451266 | 0.75 | HCAR2 (0.37) | — | |
| SCHEMBL14889608 | 0.74 | CTSS (0.31) | — | |
| SCHEMBL17152295 | 0.74 | ALDH1A1 (0.44) | — |
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-6172064-B1 | METALLOPROTEASE INHIBITOR; ANTIARTHRITIC AGENTS, ANTIDIABETIC AGENTS; ANTITUMOR AGENTS | GLAXO WELLCOME INC. | 2001-01-09 | — | — | US | disclosed |