Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.33 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2014329 | 0.85 | HRH3 (0.43) | — | |
| SCHEMBL2246634 | 0.84 | CYP1A2 (0.31) | CYP1A2 | |
| SCHEMBL5624079 | 0.84 | SIGMAR1 (0.48) | CYP1A2SIGMAR1 | |
| SCHEMBL3962258 | 0.84 | CYP1A2 (0.58) | CYP1A2 | |
| SCHEMBL1455911 | 0.82 | CYP1A2 (0.50) | CYP1A2SIGMAR1ALDH1A1 | |
| SCHEMBL7354628 | 0.82 | SIGMAR1 (0.32) | CYP1A2SIGMAR1 | |
| SCHEMBL7519477 | 0.80 | CYP1A2 (0.48) | CYP1A2SIGMAR1ALDH1A1 | |
| SCHEMBL771485 | 0.77 | — | — | |
| SCHEMBL522798 | 0.77 | — | — | |
| SCHEMBL2919715 | 0.77 | — | — |
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-4110319-A | NATURAL RUBBER OR DIENE POLYMERS | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1978-08-29 | — | — | US | disclosed |