Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.66 |
| ▸ | TSHR | P16473 | 1/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.61 |
| ▸ | DRD2 | P14416 | 8/20 | 0.56 |
| ▸ | DRD4 | P21917 | 8/20 | 0.56 |
| ▸ | DRD3 | P35462 | 7/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | HTR3A | P46098 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7505840 | 0.88 | DRD2 (0.70) | ALDH1A1TSHRKDM4ENPSR1DRD2 | |
| SCHEMBL7498479 | 0.87 | DRD4 (0.59) | ALDH1A1TSHRKDM4ENPSR1DRD2 | |
| SCHEMBL7506586 | 0.86 | DRD4 (0.56) | ALDH1A1TSHRKDM4ENPSR1DRD2 | |
| Hydrochloric Acid SCHEMBL7994911 | 0.86 | DRD2 (0.67) | ALDH1A1TSHRKDM4ENPSR1DRD2 | |
| SCHEMBL9733876 | 0.84 | TMEM97 (0.47) | ALDH1A1TSHRKDM4EDRD2DRD4 | |
| SCHEMBL7503983 | 0.82 | DRD2 (0.61) | ALDH1A1TSHRKDM4ENPSR1DRD2 | |
| SCHEMBL7503189 | 0.82 | DRD2 (0.49) | ALDH1A1TSHRKDM4ENPSR1DRD2 | |
| SCHEMBL8872544 | 0.80 | ALDH1A1 (0.78) | ALDH1A1TSHRKDM4EDRD2DRD4 | |
| SCHEMBL3585542 | 0.80 | ALDH1A1 (1.00) | ALDH1A1TSHRKDM4EDRD2DRD4 | |
| SCHEMBL13940646 | 0.80 | KMT2A (0.45) | ALDH1A1TSHRKDM4EDRD2DRD4 |
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 |