Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 3/20 | 0.41 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.41 |
| ▸ | ABL1 | P00519 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.40 |
| ▸ | JAK1 | P23458 | 5/20 | 0.38 |
| ▸ | JAK2 | O60674 | 3/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 6/20 | 0.38 |
| ▸ | AURKA | O14965 | 3/20 | 0.37 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23933505 | 1.00 | HCRTR1 (0.41) | HCRTR1HCRTR2ABL1CHRM2CHRM4 | |
| SCHEMBL23933509 | 1.00 | HCRTR1 (0.41) | HCRTR1HCRTR2ABL1CHRM2CHRM4 | |
| SCHEMBL23963986 | 0.85 | HDAC1 (0.43) | ABL1JAK1JAK2AURKAAURKB | |
| SCHEMBL30456213 | 0.85 | HDAC1 (0.43) | ABL1JAK1JAK2AURKAAURKB | |
| SCHEMBL23933469 | 0.80 | KDM1A (0.41) | HCRTR1HCRTR2ABL1CHRM2CHRM4 | |
| SCHEMBL23933466 | 0.80 | KDM1A (0.41) | HCRTR1HCRTR2ABL1CHRM2CHRM4 | |
| SCHEMBL23933473 | 0.80 | KDM1A (0.41) | HCRTR1HCRTR2ABL1CHRM2CHRM4 | |
| SCHEMBL23932221 | 0.79 | CHRM4 (0.62) | ABL1CHRM2CHRM4 | |
| SCHEMBL23932216 | 0.79 | CHRM4 (0.62) | ABL1CHRM2CHRM4 | |
| SCHEMBL23932218 | 0.79 | CHRM4 (0.62) | ABL1CHRM2CHRM4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4139303-A1 | CONDENSED SUBSTITUTED HYDROPYRROLES AS ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 | Vanderbilt University (US) | 2023-03-01 | — | — | EP | disclosed |
| WO-2021216951-A1 | CONDENSED SUBSTITUTED HYDROPYRROLES AS ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 | VANDERBILT UNIVERSITY (US) | 2021-10-28 | — | — | WO | disclosed |