Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.47 |
| ▸ | CCR5 | P51681 | 2/20 | 0.47 |
| ▸ | CCR8 | P51685 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.41 |
| ▸ | METAP2 | P50579 | 2/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | MERTK | Q12866 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23910082 | 0.81 | ALOX5AP (0.40) | TGFBR1METAP2DHODHALOX5APHTT | |
| SCHEMBL18876411 | 0.78 | CCR1 (0.56) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL3138188 | 0.78 | KDM4E (0.48) | CCR1CCR5CCR8CYP2A6TGFBR1 | |
| SCHEMBL25619165 | 0.77 | DHODH (0.36) | DHODHPTGS2ALOX5APPDK2HTT | |
| SCHEMBL17252071 | 0.77 | CCR1 (0.50) | CCR1CCR5CCR8CYP2A6TGFBR1 | |
| SCHEMBL8304819 | 0.77 | CCR1 (0.50) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL13662739 | 0.75 | CCR1 (0.52) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL26951230 | 0.73 | DHODH (0.40) | METAP2DHODHPTGS2ALOX5APPDK2 | |
| SCHEMBL6259900 | 0.72 | CCR1 (0.44) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL17809689 | 0.72 | CYP2C19 (0.45) | CCR1CCR5CCR8HDAC6CYP3A4 |
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-2023102100-A1 | ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 | VANDERBILT UNIVERSITY (US) | 2023-06-08 | — | — | WO | disclosed |