Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | PRNP | P04156 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | SI | P14410 | 2/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.37 |
| ▸ | FPR1 | P21462 | 1/20 | 0.37 |
| ▸ | FPR2 | P25090 | 1/20 | 0.37 |
| ▸ | MPO | P05164 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19354154 | 1.00 | KCNH2 (0.42) | KCNH2CYP3A4PRNPMAOBCYP1A2 | |
| SCHEMBL28446574 | 0.90 | ADORA2A (0.41) | KCNH2MAOBCACNA1CHTR2A | |
| SCHEMBL19331225 | 0.86 | KCNH2 (0.43) | KCNH2CYP3A4MAOBMAPTCACNA1C | |
| SCHEMBL296886 | 0.86 | KCNH2 (0.42) | KCNH2PRNPCACNA1CHTR2A | |
| SCHEMBL15352415 | 0.85 | PRNP (0.41) | KCNH2PRNPCACNA1CFPR1FPR2 | |
| SCHEMBL19330301 | 0.82 | CYP17A1 (0.39) | KCNH2MAOBGAA | |
| SCHEMBL19354042 | 0.82 | KCNH2 (0.39) | KCNH2CYP3A4CACNA1CMPOHTR2A | |
| SCHEMBL30701237 | 0.82 | KCNH2 (0.39) | KCNH2CYP3A4CACNA1CMPOHTR2A | |
| SCHEMBL13440257 | 0.81 | PLA2G2A (0.44) | CYP3A4CYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL12277874 | 0.80 | KCNH2 (0.37) | KCNH2CYP3A4MAOBCYP1A2CYP2D6 |
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-109069514-B | Antibacterial compound and application thereof | 结核病药物开发全球联盟公司 | 2023-12-29 | — | — | CN | disclosed |