Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 3/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.44 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 3/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2799020 | 0.80 | ADRA1B (0.52) | HTR7ADRB1KDM4ECYP2D6L3MBTL1 | |
| SCHEMBL9022985 | 0.79 | HTR7 (0.50) | HTR7ADRB1KDM4ECYP2D6L3MBTL1 | |
| SCHEMBL9023157 | 0.78 | DRD3 (0.51) | HTR7CXCR3DRD2DRD3HTR1A | |
| SCHEMBL13063399 | 0.75 | CYP17A1 (0.51) | ADRB1KDM4ECYP2D6FFAR4CXCR3 | |
| SCHEMBL9725103 | 0.74 | ADRB1 (0.59) | ADRB1KDM4ECYP2D6FFAR4CXCR3 | |
| SCHEMBL6971652 | 0.73 | ADRB1 (0.62) | ADRB1KDM4ECYP2D6FFAR4CXCR3 | |
| SCHEMBL12968838 | 0.72 | ADRB1 (0.68) | ADRB1KDM4ECYP2D6FFAR4PPARG | |
| SCHEMBL6711653 | 0.69 | DRD3 (0.62) | HTR7ADRB1KDM4EL3MBTL1DRD2 | |
| SCHEMBL9014751 | 0.68 | DRD2 (0.45) | HTR7ADRB1KDM4ECYP2D6PPARG | |
| SCHEMBL18176129 | 0.68 | ADRB1 (0.73) | ADRB1KDM4ECYP2D6FFAR4PPARG |
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 |
|---|---|---|---|---|---|---|---|
| EP-0482696-B1 | 4-[4- or 6-(Trifluoromethyl-2-pyridinyl)]-1-piperazinyl-alkyl substituted lactams | AKZO NOBEL NV (NL) | 1996-01-10 | — | — | EP | disclosed |
| US-5180726-A | 4-[4- or 6-(trifluoromethyl-2-pyridinyl)]-1-piperazinylalkyl substituted lactams | AKZO N.V. (NL) | 1993-01-19 | — | — | US | disclosed |
| EP-0482696-A1 | 4-[4- or 6-(Trifluoromethyl-2-pyridinyl)]-1-piperazinyl-alkyl substituted lactams | Akzo Nobel N.V. (NL) | 1992-04-29 | — | — | EP | disclosed |