Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 3/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.34 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.34 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1543906 | 0.94 | AOC3 (0.36) | AOC3 | |
| SCHEMBL3756197 | 0.82 | CACNA1B (0.35) | AOC3 | |
| SCHEMBL13792137 | 0.82 | ALDH1A1 (0.41) | CYP17A1FFAR1 | |
| SCHEMBL11487942 | 0.81 | CYP17A1 (0.48) | CYP17A1FFAR1DPP4KCNH2DPP8 | |
| SCHEMBL27900218 | 0.81 | CYP17A1 (0.39) | CYP17A1FFAR1DPP4KCNH2DPP8 | |
| SCHEMBL11493405 | 0.81 | TRPA1 (0.42) | CYP17A1FFAR1DPP4KCNH2DPP8 | |
| SCHEMBL11487070 | 0.81 | MAOB (0.46) | CYP17A1FFAR1DPP4KCNH2DPP8 | |
| Hydrochloric Acid SCHEMBL11493325 | 0.79 | MAOB (0.48) | CYP17A1FFAR1DPP4KCNH2DPP8 | |
| SCHEMBL11493802 | 0.79 | MAOB (0.42) | CYP17A1FFAR1DPP4KCNH2DPP8 | |
| SCHEMBL11489248 | 0.79 | CYP17A1 (0.39) | CYP17A1 |
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-4239759-A | Morpholino containing compounds, compositions and use thereof | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1980-12-16 | — | — | US | disclosed |
| US-4110447-A | Anti-inflammatory (halo-4-biphenylyl)-alkanolamines | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1978-08-29 | — | — | US | disclosed |