Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SUCNR1 | Q9BXA5 | 5/20 | 0.48 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
| ▸ | ACACA | Q13085 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 5/20 | 0.42 |
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CKS1B | P61024 | 1/20 | 0.39 |
| ▸ | SKP1 | P63208 | 1/20 | 0.39 |
| ▸ | SKP2 | Q13309 | 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 | |
|---|---|---|---|---|
| SCHEMBL18012836 | 0.99 | SUCNR1 (0.49) | SUCNR1ACACBACACADRD2P2RY12 | |
| SCHEMBL17966554 | 0.91 | SUCNR1 (0.46) | SUCNR1ACACBACACADRD2P2RY12 | |
| Lithium Ion SCHEMBL17966543 | 0.90 | SUCNR1 (0.46) | SUCNR1ACACBACACADRD2P2RY12 | |
| SCHEMBL17966514 | 0.89 | SUCNR1 (0.41) | SUCNR1ACACBACACAP2RY12CKS1B | |
| SCHEMBL18012770 | 0.88 | SUCNR1 (0.42) | SUCNR1ACACBACACAP2RY12CKS1B | |
| SCHEMBL17998113 | 0.88 | DRD2 (0.43) | SUCNR1ACACBACACADRD2CYP3A4 | |
| SCHEMBL30875448 | 0.88 | DRD2 (0.43) | SUCNR1ACACBACACADRD2CYP3A4 | |
| Lithium SCHEMBL17966518 | 0.88 | SUCNR1 (0.41) | SUCNR1ACACBACACAP2RY12CKS1B | |
| SCHEMBL17998112 | 0.83 | CACNA1G (0.49) | DRD2CYP3A4CKS1BSKP1SKP2 | |
| SCHEMBL19407199 | 0.83 | DRD2 (0.42) | SUCNR1ACACBACACADRD2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107849055-B | Macrocyclic compounds useful as IRAK1/4 inhibitors and uses thereof | 默克专利有限公司 | 2020-08-07 | — | — | CN | disclosed |