Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.72 |
| ▸ | HTR1A | P08908 | 8/20 | 0.71 |
| ▸ | HTR7 | P34969 | 4/20 | 0.67 |
| ▸ | DRD2 | P14416 | 6/20 | 0.65 |
| ▸ | HTR2A | P28223 | 3/20 | 0.65 |
| ▸ | HTR6 | P50406 | 2/20 | 0.65 |
| ▸ | DRD3 | P35462 | 2/20 | 0.64 |
| ▸ | DRD4 | P21917 | 2/20 | 0.64 |
| ▸ | DRD1 | P21728 | 1/20 | 0.61 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.59 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.59 |
| ▸ | HRH2 | P25021 | 1/20 | 0.59 |
| ▸ | HTR1B | P28222 | 1/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.59 |
| ▸ | HRH1 | P35367 | 1/20 | 0.59 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.59 |
| ▸ | HTR2B | P41595 | 1/20 | 0.59 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27554801 | 0.99 | KCNH2 (0.70) | KCNH2HTR1AHTR7DRD2HTR2A | |
| SCHEMBL7042730 | 0.98 | HTR1A (0.71) | KCNH2HTR1AHTR7DRD2HTR2A | |
| Hydrochloric Acid SCHEMBL6867088 | 0.96 | HTR1A (0.70) | KCNH2HTR1AHTR7DRD2HTR2A | |
| SCHEMBL6860398 | 0.93 | HTR1A (0.74) | KCNH2HTR1AHTR7DRD2HTR2A | |
| Hydrochloric Acid SCHEMBL7651348 | 0.92 | HTR1A (0.73) | KCNH2HTR1AHTR7DRD2HTR2A | |
| SCHEMBL4525293 | 0.85 | KCNH2 (1.00) | KCNH2HTR1AHTR7DRD2HTR2A | |
| SCHEMBL7735999 | 0.84 | HTR1A (0.69) | HTR1AHTR7DRD2HTR2AHTR6 | |
| SCHEMBL27910180 | 0.84 | KCNH2 (0.69) | KCNH2HTR1AHTR7DRD2HTR2A | |
| Hydrochloric Acid SCHEMBL6866192 | 0.83 | HTR1A (0.68) | HTR1AHTR7DRD2HTR2AHTR6 | |
| SCHEMBL6869328 | 0.81 | DRD2 (0.71) | KCNH2HTR1AHTR7DRD2DRD3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1168714-C | Arylpiperazine derivatives useful as uroselective alpha-adrenoceptor blockers | ʵ | 2004-09-29 | — | — | CN | claimed |
| CN-1318052-A | Arylpiperazine derivatives useful as uroselective alpha-adrenoceptor blockers | RANBAXY LAB LTD (IN) | 2001-10-17 | — | — | CN | claimed |
| CN-1168714-C | Arylpiperazine derivatives useful as uroselective alpha-adrenoceptor blockers | ʵ | 2004-09-29 | — | — | CN | disclosed |