Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 9/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 8/20 | 0.45 |
| ▸ | DRD3 | P35462 | 8/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.37 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27449673 | 0.88 | ALDH1A1 (0.43) | DRD2HTR1ADRD4DRD3KDM4E | |
| SCHEMBL7505840 | 0.81 | DRD2 (0.70) | DRD2HTR1ADRD4DRD3KDM4E | |
| SCHEMBL7499824 | 0.80 | DRD2 (0.60) | DRD2HTR1ADRD4DRD3KDM4E | |
| SCHEMBL7497720 | 0.80 | DRD2 (0.58) | DRD2HTR1ADRD4DRD3KDM4E | |
| Hydrochloric Acid SCHEMBL7994911 | 0.79 | DRD2 (0.67) | DRD2HTR1ADRD4DRD3KDM4E | |
| SCHEMBL7501593 | 0.78 | DRD2 (0.55) | DRD2HTR1ADRD4DRD3KDM4E | |
| SCHEMBL30484457 | 0.78 | DRD2 (0.50) | DRD2HTR1ADRD4DRD3KDM4E | |
| SCHEMBL10466103 | 0.78 | DRD2 (0.48) | DRD2HTR1ADRD4DRD3 | |
| SCHEMBL7506766 | 0.78 | DRD2 (0.65) | DRD2HTR1ADRD4DRD3KDM4E | |
| SCHEMBL7503436 | 0.78 | DRD2 (0.63) | DRD2HTR1ADRD4DRD3KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-1114594-C | D4 receptor selectivity piperazine derivatives | MERCK PATENT GMBH (DE) | 2003-07-16 | — | — | CN | disclosed |
| CN-1230180-A | Piperazine derivatives with D4 receptor selectivity | MERCK PATENT GMBH (DE) | 1999-09-29 | — | — | CN | disclosed |