Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 7/20 | 0.57 |
| ▸ | HTR1A | P08908 | 5/20 | 0.57 |
| ▸ | HTR6 | P50406 | 6/20 | 0.54 |
| ▸ | HTR2A | P28223 | 2/20 | 0.54 |
| ▸ | HTR5A | P47898 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 2/20 | 0.48 |
| ▸ | BMPR1A | P36894 | 2/20 | 0.47 |
| ▸ | ACVR1B | P36896 | 2/20 | 0.47 |
| ▸ | ACVRL1 | P37023 | 2/20 | 0.47 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | NPY2R | P49146 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.46 |
| ▸ | HTR3B | O95264 | 1/20 | 0.46 |
| ▸ | HTR3A | P46098 | 1/20 | 0.46 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.46 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4909469 | 0.87 | HTR7 (0.58) | HTR7HTR1AHTR6HTR2AHTR5A | |
| SCHEMBL6560075 | 0.81 | ADRB1 (0.62) | HTR7HTR1AHTR6HTR2AHTR5A | |
| SCHEMBL1199430 | 0.80 | BMPR1A (0.49) | HTR7HTR1AHTR6HTR2AHTR2B | |
| SCHEMBL27687362 | 0.80 | HTR6 (0.57) | HTR7HTR1AHTR6HTR2AHTR5A | |
| SCHEMBL27687351 | 0.79 | HTR6 (0.56) | HTR7HTR1AHTR6HTR2AHTR5A | |
| SCHEMBL26305077 | 0.79 | KDR (0.43) | HTR7HTR1AHTR6HTR2BBMPR1A | |
| SCHEMBL26131711 | 0.78 | HTR1A (0.47) | HTR7HTR1AHTR6HTR2AHTR5A | |
| SCHEMBL233938 | 0.78 | KDR (0.53) | HTR7HTR1AHTR6HTR2AHTR2B | |
| SCHEMBL29557426 | 0.78 | KDR (0.53) | HTR7HTR1AHTR6HTR2AHTR2B | |
| SCHEMBL7059249 | 0.77 | HTR3A (0.65) | HTR7HTR1AHTR6HTR2AHTR5A |
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-2003028728-A1 | 4-(4-SUBSTITUTED PIPERAZINYL-1YL)-BUTYLCARBOXAMIDES AS D3 DOPAMINE SUBTYPE SELECTIVE LIGANDS | Richter Gedeon Vegyészeti Gyár Rt. (HU) | 2003-04-10 | — | — | WO | disclosed |