Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15651507 | 0.79 | CYP2A6 (0.46) | CYP2A6 | |
| SCHEMBL10855251 | 0.79 | NOS3 (0.36) | — | |
| SCHEMBL3802865 | 0.79 | RECQL (0.36) | CYP19A1 | |
| SCHEMBL3799743 | 0.79 | CYP19A1 (0.33) | CYP19A1 | |
| SCHEMBL29935668 | 0.79 | CYP2A6 (0.46) | CYP2A6 | |
| SCHEMBL22778675 | 0.75 | HTR1B (0.39) | — | |
| SCHEMBL28063797 | 0.74 | MEN1 (0.45) | — | |
| SCHEMBL10555013 | 0.72 | HRH3 (0.38) | — | |
| SCHEMBL29950798 | 0.69 | CHRM2 (0.56) | CHRM2CHRM1CHRM3CYP2A6CYP19A1 | |
| SCHEMBL418936 | 0.68 | DYRK1A (0.33) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3810593-A1 | OGA INHIBITOR COMPOUNDS | Janssen Pharmaceutica NV (BE) | 2021-04-28 | — | — | EP | disclosed |
| WO-2019243526-A1 | OGA INHIBITOR COMPOUNDS | JANSSEN PHARMACEUTICA NV (BE) | 2019-12-26 | — | — | WO | disclosed |
| EP-2588465-A1 | SGC STIMULATORS | Ironwood Pharmaceuticals, Inc. (US) | 2013-05-08 | — | — | EP | disclosed |
| WO-2012003405-A1 | SGC STIMULATORS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2012-01-05 | — | — | WO | disclosed |