Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | PTGER1 | P34995 | 11/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 3/20 | 0.33 |
| ▸ | CCR5 | P51681 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.30 |
| ▸ | PPARA | Q07869 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21786458 | 0.86 | PTGER1 (0.34) | MAOBMAOAPTGER1MRGPRX4CCR5 | |
| SCHEMBL22790980 | 0.82 | PTGER1 (0.35) | PTGER1MRGPRX4CCR5CYP2C9KCNA3 | |
| SCHEMBL21786459 | 0.81 | STIM1 (0.35) | PTGER1MRGPRX4CCR5CYP2C9 | |
| SCHEMBL22791090 | 0.79 | MRGPRX4 (0.36) | PTGER1MRGPRX4CCR5CYP2C9KCNA3 | |
| SCHEMBL21786413 | 0.74 | MAPT (0.36) | PTGER1MRGPRX4CCR5KCNA3 | |
| SCHEMBL22790984 | 0.72 | STIM1 (0.40) | MRGPRX4CCR5CYP2C9KCNA3 | |
| SCHEMBL19319821 | 0.72 | MAOB (0.38) | MAOBMAOACYP2C9 | |
| SCHEMBL19319830 | 0.72 | ALOX5AP (0.38) | MAOBMAOACYP2C9 | |
| SCHEMBL21786619 | 0.70 | MAPT (0.36) | MRGPRX4CCR5KCNA3 | |
| SCHEMBL21786627 | 0.67 | MAPT (0.41) | PTGER1MRGPRX4 |
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-2020046382-A1 | SUBSTITUTED HETEROCYCLES AS C-MYC TARGETING AGENTS | NORTHWESTERN UNIVERSITY (US) | 2020-03-05 | — | — | WO | disclosed |