Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL28052618 | 0.73 | IDO1 (0.35) | MAOABCHEIDO1PTGS1PTGS2 | |
| SCHEMBL8469462 | 0.72 | MAOA (0.34) | MAOABCHEGSK3B | |
| SCHEMBL4822999 | 0.67 | MAOA (0.41) | MAOABCHEGSK3B | |
| SCHEMBL30923520 | 0.67 | MAOA (0.41) | MAOABCHEGSK3B | |
| Iodide SCHEMBL7694591 | 0.65 | MAOA (0.39) | MAOABCHEGSK3B | |
| SCHEMBL27843499 | 0.64 | GSK3B (0.42) | BCHEGSK3B | |
| SCHEMBL212848 | 0.63 | MAOA (0.33) | MAOABCHE | |
| SCHEMBL514686 | 0.63 | ALDH1A1 (0.35) | MAOABCHEGSK3B | |
| SCHEMBL303391 | 0.63 | MAOA (0.33) | MAOAPTGS1PTGS2 | |
| SCHEMBL11810556 | 0.63 | MAOA (0.37) | MAOABCHE |
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-5141978-A | PROCESSING OF POLYURETHANE RUBBERS | RHEIN CHEMIE RHEINAU GMBH (DE) | 1992-08-25 | — | — | US | disclosed |