Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6975129 | 1.00 | KDM1A (0.42) | KDM1AMAOBHDAC9SIGMAR1MAPK1 | |
| SCHEMBL10483582 | 0.89 | KDM1A (0.51) | KDM1ASIGMAR1 | |
| SCHEMBL30786026 | 0.81 | KDM1A (0.42) | KDM1AMAOBHDAC9MAPK1SMN1; SMN2 | |
| SCHEMBL20362220 | 0.81 | KDM1A (0.42) | KDM1AMAOBHDAC9MAPK1SMN1; SMN2 | |
| SCHEMBL3665678 | 0.77 | HDAC9 (0.42) | KDM1AMAOBHDAC9MAPK1SMN1; SMN2 | |
| SCHEMBL4348712 | 0.76 | MAOB (0.38) | KDM1AMAOBHDAC9SIGMAR1MAPK1 | |
| SCHEMBL18088803 | 0.74 | KDM1A (0.44) | KDM1AMAOBHDAC9 | |
| SCHEMBL13198414 | 0.74 | KDM1A (0.44) | KDM1AMAOBHDAC9 | |
| SCHEMBL3941515 | 0.74 | KDM1A (0.46) | KDM1AMAOBHDAC9SIGMAR1MAPK1 | |
| SCHEMBL19130582 | 0.74 | KDM1A (0.46) | KDM1AMAOBHDAC9SIGMAR1MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6025177-A | ENANTIOSELECTIVE SYNTHESIS OF CHIRAL ALPHA-HYDROXYCARBOXYLATE BY REACTING A PROCHIRAL ALPHA-KETOCARBOXYLIC ACID WITH A SINGLE ENANTIOMER OF AN N-SUBSTITUTED VICINAL AMINOALCOHOL OF SPECIFIC CYCLOHYDROCARBONS TO FORM ALPHA-HYDROXYCARBOXYLATE | SEPRACOR INC. (US) | 2000-02-15 | — | — | US | disclosed |
| US-6013830-A | CHEMICAL INTERMEDIATES FOR OXYBUTYNIN, OXYPHENCYCLIMINE, OXYPHENONIUM BROMIDE, OXYPYRRONIUM BROMIDE, AND OXYSONIUM IODIDE, FOR WHICH CYCLOHEXYLPHENYLGLYCOLIC ACID (CHPGA) IS OF SPECIAL INTEREST; STEREOSELECTIVITY | SEPRACOR INC. (US) | 2000-01-11 | — | — | US | disclosed |