Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 2/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
| ▸ | PTPRB | P23467 | 1/20 | 0.34 |
| ▸ | REN | P00797 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25624750 | 1.00 | CACNA1B (0.38) | CACNA1BEPHX2GPR139CTSSCTSK | |
| SCHEMBL27406042 | 0.90 | CACNA1B (0.43) | CACNA1BCTSSCTSKROCK2PRKG1 | |
| SCHEMBL29861275 | 0.90 | CACNA1B (0.43) | CACNA1BCTSSCTSKROCK2PRKG1 | |
| SCHEMBL24036823 | 0.85 | CACNA1B (0.41) | CACNA1BEPHX2GPR139CTSSCTSK | |
| SCHEMBL25624830 | 0.85 | GPR139 (0.42) | EPHX2GPR139CTSSCTSKPTPRB | |
| SCHEMBL24036832 | 0.84 | WDR5 (0.44) | EPHX2GPR139CTSSCTSKPTPRB | |
| SCHEMBL24036746 | 0.84 | GPR139 (0.39) | EPHX2GPR139CTSSCTSKPTPRB | |
| SCHEMBL25753975 | 0.84 | EGFR (0.43) | EPHX2GPR139CTSSCTSKHDAC3 | |
| SCHEMBL24036744 | 0.82 | ITGB3 (0.40) | CACNA1BEPHX2GPR139CTSSCTSK | |
| SCHEMBL24036747 | 0.82 | GPR139 (0.46) | GPR139CTSSCTSKHDAC1HDAC8 |
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-2021230325-A1 | 1, 4, 5, 6-TETRAHYDROPYRIMIDINE-2-AMINE DERIVATIVE | 宇部興産株式会社 | 2021-11-18 | — | — | WO | disclosed |