Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 6/20 | 0.65 |
| ▸ | HTR7 | P34969 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 6/20 | 0.51 |
| ▸ | DRD3 | P35462 | 5/20 | 0.51 |
| ▸ | HTR1A | P08908 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | SRPK1 | Q96SB4 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7991752 | 0.92 | DRD4 (0.79) | DRD4HTR7KDM4EDRD2DRD3 | |
| SCHEMBL7506230 | 0.88 | DRD4 (0.56) | DRD4HTR7KDM4EALDH1A1NPSR1 | |
| SCHEMBL7499748 | 0.81 | SLC2A1 (0.57) | DRD4HTR7KDM4EALDH1A1DRD2 | |
| SCHEMBL7991732 | 0.79 | DRD4 (1.00) | DRD4HTR7KDM4EALDH1A1DRD2 | |
| SCHEMBL7507938 | 0.78 | SLC2A1 (0.58) | DRD4HTR7KDM4EDRD2DRD3 | |
| SCHEMBL7507348 | 0.77 | DRD4 (0.72) | DRD4HTR7KDM4EALDH1A1DRD2 | |
| SCHEMBL7502837 | 0.77 | DRD2 (0.76) | DRD4KDM4EALDH1A1DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL7989155 | 0.76 | DRD4 (0.71) | DRD4HTR7KDM4EALDH1A1DRD2 | |
| SCHEMBL12962319 | 0.76 | DRD4 (0.91) | DRD4HTR7KDM4EALDH1A1DRD2 | |
| SCHEMBL7502452 | 0.75 | DRD4 (0.69) | DRD4HTR7KDM4EALDH1A1DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0931067-B1 | D4 RECEPTOR SELECTIVITY PIPERAZINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2002-06-26 | — | — | EP | disclosed |
| US-6258813-B1 | BIOLOGICAL RECEPTORS WITH TETRAHYDROPIPERIZINE DERIVATIVES | MERCK PATENT GESELLSCHAFT MIT (DE) | 2001-07-10 | — | — | US | disclosed |
| EP-0931067-A1 | D4 RECEPTOR SELECTIVITY PIPERAZINE DERIVATIVES | MERCK PATENT GmbH (DE) | 1999-07-28 | — | — | EP | disclosed |
| WO-1998011068-A1 | D4 RECEPTOR SELECTIVITY PIPERAZINE DERIVATIVES | MERCK PATENT GMBH (DE) | 1998-03-19 | — | — | WO | disclosed |