Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 6/20 | 0.46 |
| ▸ | HTR1A | P08908 | 5/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 4/20 | 0.44 |
| ▸ | DRD4 | P21917 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.41 |
| ▸ | DRD5 | P21918 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | HTR7 | P34969 | 2/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | ATP4A | P20648 | 1/20 | 0.40 |
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 SCHEMBL6957118 | 0.99 | DRD2 (0.45) | DRD2HTR1AADORA1DRD3DRD4 | |
| SCHEMBL6952045 | 0.93 | DRD3 (0.53) | DRD2HTR1AADORA1DRD3DRD4 | |
| Hydrochloric Acid SCHEMBL6960476 | 0.92 | DRD3 (0.52) | DRD2HTR1AADORA1DRD3DRD4 | |
| SCHEMBL6952207 | 0.92 | HTR1A (0.49) | DRD2HTR1ADRD3DRD4KCNH2 | |
| Hydrochloric Acid SCHEMBL6959796 | 0.91 | HTR1A (0.48) | DRD2HTR1ADRD3DRD4KCNH2 | |
| SCHEMBL6953511 | 0.88 | ADORA1 (0.47) | DRD2ADORA1DRD3DRD4HTR7 | |
| Hydrochloric Acid SCHEMBL6959246 | 0.87 | ADORA1 (0.46) | DRD2ADORA1DRD3DRD4HTR7 | |
| SCHEMBL7082241 | 0.79 | SIGMAR1 (0.52) | DRD2HTR1AADORA1DRD3DRD4 | |
| Hydrochloric Acid SCHEMBL6956636 | 0.78 | DRD2 (0.52) | DRD2HTR1AADORA1DRD3DRD4 | |
| SCHEMBL7084707 | 0.75 | SIGMAR1 (0.57) | DRD2HTR1ADRD3DRD4ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0851862-B1 | 1(HETERO)ARYL-4-(CONDENSED THIAZOL-2-YLALKYL)-PIPERAZINE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF 5-HT1A-RECEPTOR MEDIATED DISORDERS | PHARMACIA ITALIA SPA (IT) | 2003-09-10 | — | — | EP | claimed |