Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 9/20 | 0.83 |
| ▸ | DRD2 | P14416 | 9/20 | 0.83 |
| ▸ | DRD3 | P35462 | 8/20 | 0.83 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | HTT | P42858 | 3/20 | 0.59 |
| ▸ | TSHR | P16473 | 3/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HTR7 | P34969 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7504486 | 0.91 | DRD2 (1.00) | DRD4DRD2DRD3ALDH1A1HTT | |
| Hydrochloric Acid SCHEMBL7991758 | 0.89 | DRD2 (0.96) | DRD4DRD2DRD3ALDH1A1HTT | |
| SCHEMBL13219071 | 0.84 | ALDH1A1 (0.74) | DRD4DRD2DRD3ALDH1A1HTT | |
| SCHEMBL7502588 | 0.83 | DRD4 (0.83) | DRD4DRD2DRD3HTR1AHTR7 | |
| SCHEMBL8111511 | 0.81 | HTT (0.77) | DRD4DRD2DRD3ALDH1A1HTT | |
| SCHEMBL6587585 | 0.80 | DRD2 (0.61) | DRD4DRD2DRD3HTR1A | |
| SCHEMBL7679008 | 0.79 | DRD2 (0.61) | DRD4DRD2DRD3NPC1RAB9A | |
| SCHEMBL7505618 | 0.78 | DRD2 (0.86) | DRD4DRD2DRD3ALDH1A1TSHR | |
| SCHEMBL7498385 | 0.78 | DRD2 (0.64) | DRD4DRD2DRD3ALDH1A1KDM4E | |
| SCHEMBL7501554 | 0.77 | DRD2 (1.00) | DRD4DRD2DRD3ALDH1A1KDM4E |
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 6 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 |
| 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 |
| CN-1230180-A | Piperazine derivatives with D4 receptor selectivity | MERCK PATENT GMBH (DE) | 1999-09-29 | — | — | CN | 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 |