Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALPL | P05186 | 2/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.30 |
| ▸ | GPBAR1 | Q8TDU6 | 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 | |
|---|---|---|---|---|
| SCHEMBL278789 | 0.68 | GAA (0.47) | HSP90AB1MAPTHSD11B1PTGS1PTGS2 | |
| SCHEMBL29473428 | 0.66 | GPBAR1 (0.42) | HSP90AB1MAPTNPSR1ALPLLMNA | |
| SCHEMBL13147201 | 0.64 | TRPA1 (0.51) | HSD11B1LMNACYP1A2PDK2 | |
| SCHEMBL144686 | 0.63 | TP53 (0.42) | HSP90AB1HSD11B1CYP1A2 | |
| SCHEMBL10030392 | 0.63 | GLA (0.54) | HSP90AB1HSD11B1CYP1A2PDK2 | |
| SCHEMBL22447434 | 0.63 | AR (0.42) | HSP90AB1MAPTHSD11B1PDK2 | |
| SCHEMBL28726685 | 0.63 | NOS3 (0.43) | HSP90AB1ALPLLMNACA9CYP1A2 | |
| SCHEMBL2600185 | 0.62 | GAA (0.69) | HSP90AB1MAPTNPSR1PTGS1PTGS2 | |
| SCHEMBL23373938 | 0.62 | GAA (0.40) | HSP90AB1MAPTHSD11B1PTGS1PTGS2 | |
| SCHEMBL91841 | 0.62 | AR (0.44) | HSP90AB1HSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021216951-A1 | CONDENSED SUBSTITUTED HYDROPYRROLES AS ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 | VANDERBILT UNIVERSITY (US) | 2021-10-28 | — | — | WO | disclosed |