Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 2/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 7/20 | 0.39 |
| ▸ | HTR6 | P50406 | 3/20 | 0.38 |
| ▸ | HTR5A | P47898 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
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 SCHEMBL7882760 | 0.99 | HTR1A (0.42) | HTR1AHTR2ADRD2DRD4DRD3 | |
| SCHEMBL5996608 | 0.89 | PARP1 (0.39) | — | |
| Hydrochloric Acid SCHEMBL7723748 | 0.87 | PARP1 (0.38) | — | |
| SCHEMBL4552739 | 0.83 | PIM1 (0.36) | HTR1AHTR2ADRD2DRD4DRD3 | |
| SCHEMBL7883990 | 0.81 | HTR1A (0.38) | HTR1AHTR2ADRD2DRD4DRD3 | |
| Alcohol SCHEMBL28156339 | 0.77 | HTR7 (0.52) | HTR1AHTR2ADRD2DRD4DRD3 | |
| SCHEMBL7964016 | 0.77 | KMT2A (0.36) | — | |
| Hydrochloric Acid SCHEMBL7727011 | 0.75 | KDM4E (0.43) | — | |
| SCHEMBL8352376 | 0.75 | PARP1 (0.41) | HTR2A | |
| SCHEMBL10911536 | 0.72 | GSK3B (0.41) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE37729-E1 | 4-Heteroaryl-1-piperidinealkylamines and derivatives thereof and their therapeutic utility | AVENTIS PHARMACEUTICALS INC. | 2002-06-04 | — | — | US | disclosed |
| US-RE37478-E1 | COMPOUNDS WITH HETEROCYCLIC AMINO COMPOUNDS | AVENTIS PHARMACEUTICALS, INC. | 2001-12-18 | — | — | US | disclosed |
| US-6207680-B1 | FOR THERAPY OF PSYCHOLOGICAL DISORDERS AND PAIN | AVENTIS PHARMACEUTICALS INC. | 2001-03-27 | — | — | US | disclosed |
| US-RE37029-E1 | ANTIPSYCHOTIC AND ANALGESIC AGENTS | AVENTIS PHARMACEUTICALS INC. | 2001-01-23 | — | — | US | disclosed |