Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.55 |
| ▸ | DRD3 | P35462 | 3/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | HTR7 | P34969 | 1/20 | 0.52 |
| ▸ | DHFR | P00374 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | XBP1 | P17861 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | PHGDH | O43175 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7500786 | 0.91 | DRD2 (0.64) | DRD2DRD3ADRA1AKDM4EPOLB | |
| SCHEMBL7499824 | 0.85 | DRD2 (0.60) | DRD2DRD3ADRA1AKDM4EHTR1A | |
| SCHEMBL27539153 | 0.83 | SMO (0.57) | DRD2DRD3KDM4EHTR1AMAPT | |
| SCHEMBL7505840 | 0.79 | DRD2 (0.70) | DRD2DRD3KDM4EPOLBHTR1A | |
| SCHEMBL4924188 | 0.79 | DRD2 (0.86) | DRD2DRD3ADRA1AHTR1AHTR7 | |
| SCHEMBL7506594 | 0.79 | DRD2 (0.74) | DRD2DRD3KDM4EPOLBHTR1A | |
| SCHEMBL27425923 | 0.78 | DRD2 (0.51) | DRD2DRD3KDM4EHTR1ALMNA | |
| Hydrochloric Acid SCHEMBL7995172 | 0.78 | DRD2 (0.72) | DRD2DRD3KDM4EPOLBHTR1A | |
| Hydrochloric Acid SCHEMBL7994911 | 0.78 | DRD2 (0.67) | DRD2DRD3KDM4EPOLBHTR1A | |
| SCHEMBL7506766 | 0.77 | DRD2 (0.65) | DRD2DRD3KDM4EPOLBHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |