Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 9/20 | 0.61 |
| ▸ | DRD4 | P21917 | 9/20 | 0.61 |
| ▸ | DRD3 | P35462 | 9/20 | 0.61 |
| ▸ | HTR1A | P08908 | 8/20 | 0.61 |
| ▸ | HTR2A | P28223 | 6/20 | 0.61 |
| ▸ | HTR2C | P28335 | 5/20 | 0.61 |
| ▸ | HRH1 | P35367 | 3/20 | 0.61 |
| ▸ | TMEM97 | Q5BJF2 | 4/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.57 |
| ▸ | DRD1 | P21728 | 2/20 | 0.57 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.57 |
| ▸ | HTR2B | P41595 | 1/20 | 0.57 |
| ▸ | HTR6 | P50406 | 1/20 | 0.57 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | HTR7 | P34969 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7080948 | 0.84 | DRD2 (0.67) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL11832182 | 0.81 | DRD2 (0.88) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL11833639 | 0.81 | DRD2 (0.78) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL6704972 | 0.78 | ALDH1A1 (0.62) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL8211816 | 0.76 | DRD2 (0.78) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL6234537 | 0.76 | DRD2 (0.77) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL10787976 | 0.75 | DRD2 (0.59) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL4704279 | 0.74 | KDM2B (0.48) | DRD2DRD3HTR1AHTR2AHTR2C | |
| SCHEMBL16986166 | 0.74 | TSHR (0.97) | DRD2DRD4DRD3HTR1AHTR2A | |
| SCHEMBL10904101 | 0.73 | HTR1A (0.69) | DRD2DRD4DRD3HTR1AHTR2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1326842-A1 | ARYLPIPERAZINE DERIVATIVES AND THEIR USE AS PSYCHOTROPIC AGENTS | MERCK PATENT GmbH (DE) | 2003-07-16 | — | — | EP | disclosed |
| WO-2002020491-A1 | ARYLPIPERAZINE DERIVATIVES AND THEIR USE AS PSYCHOTROPIC AGENTS | MERCK PATENT GMBH (DE) | 2002-03-14 | — | — | WO | disclosed |