Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 6/20 | 0.40 |
| ▸ | CA1 | P00915 | 6/20 | 0.40 |
| ▸ | CA2 | P00918 | 6/20 | 0.40 |
| ▸ | CA9 | Q16790 | 6/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.40 |
| ▸ | CA4 | P22748 | 3/20 | 0.40 |
| ▸ | CA6 | P23280 | 3/20 | 0.40 |
| ▸ | CA5A | P35218 | 3/20 | 0.40 |
| ▸ | CA7 | P43166 | 3/20 | 0.40 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP7 | P09237 | 1/20 | 0.39 |
| ▸ | MMP10 | P09238 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16134191 | 0.89 | CA12 (0.44) | HRH3HRH4CA12CA1CA2 | |
| SCHEMBL11306494 | 0.82 | HCAR3 (0.46) | KCNH3KMT2A | |
| SCHEMBL19985663 | 0.81 | HRH3 (0.43) | HRH3CA12CA1CA2CA9 | |
| SCHEMBL24771038 | 0.79 | CA12 (0.38) | HRH3HRH4CA12CA1CA2 | |
| SCHEMBL18757520 | 0.78 | KDM4E (0.51) | PIM1PIM2CA12CA1CA2 | |
| SCHEMBL4758951 | 0.78 | DYRK1B (0.40) | HRH3PIM1PIM2CA12CA1 | |
| SCHEMBL17563731 | 0.78 | KDM4E (0.50) | CA12CA1CA2CA9CA14 | |
| SCHEMBL17563730 | 0.73 | CXCR4 (0.46) | CA12CA9CA14CA4CA6 | |
| SCHEMBL18466757 | 0.73 | KDM4E (0.52) | CA12CA1CA2CA9CA14 | |
| SCHEMBL22693647 | 0.71 | SLC29A1 (0.47) | CA12CA1CA2CA9CA14 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2906584-B1 | NOVEL ALPHA4BETA7 PEPTIDE DIMER ANTAGONISTS | PROTAGONIST THERAPEUTICS INC (US) | 2019-11-20 | — | — | EP | disclosed |