Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 7/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 2/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.39 |
| ▸ | CDK9 | P50750 | 4/20 | 0.39 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2214191 | 0.89 | PDE4B (0.46) | PDE4BHDAC1HDAC2RORCTACR1 | |
| SCHEMBL1972088 | 0.83 | RORC (0.42) | PDE4BHDAC1HDAC2RORCCCNT1 | |
| SCHEMBL23951690 | 0.83 | PDE4B (0.70) | PDE4BHDAC1HDAC2RORCTACR1 | |
| SCHEMBL14498543 | 0.83 | PDE4B (0.70) | PDE4BHDAC1HDAC2RORCTACR1 | |
| SCHEMBL4006266 | 0.83 | PDE4B (0.70) | PDE4BHDAC1HDAC2RORCTACR1 | |
| SCHEMBL13473874 | 0.82 | MC4R (0.39) | — | |
| SCHEMBL20743115 | 0.81 | ALOX5AP (0.45) | HDAC1HDAC2RORCTGFBR1 | |
| SCHEMBL18914417 | 0.79 | PDE4B (0.59) | PDE4BHDAC1HDAC2TACR1USP30 | |
| SCHEMBL13525795 | 0.79 | PDE4B (0.59) | PDE4BHDAC1HDAC2TACR1USP30 | |
| SCHEMBL23062605 | 0.78 | ALDH1A1 (0.49) | PDE4BUSP30 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE49686-E1 | Nitrogen-containing heterocyclic compound and use of same | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2023-10-10 | — | — | US | disclosed |