Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 3/20 | 0.45 |
| ▸ | DRD4 | P21917 | 3/20 | 0.45 |
| ▸ | DRD3 | P35462 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4711818 | 0.78 | DRD2 (0.58) | KDM4EALDH1A1NPSR1DRD2DRD4 | |
| SCHEMBL4710340 | 0.76 | PPARD (0.52) | KDM4EALDH1A1NPSR1DRD2DRD4 | |
| SCHEMBL4710392 | 0.75 | HTT (0.52) | KDM4EALDH1A1NPSR1DRD2DRD4 | |
| SCHEMBL14160136 | 0.74 | DRD2 (0.56) | KDM4EALDH1A1NPSR1DRD2DRD4 | |
| SCHEMBL11181299 | 0.73 | LMNA (0.64) | KDM4EALDH1A1NPSR1DRD2DRD4 | |
| SCHEMBL4709107 | 0.73 | LMNA (0.55) | KDM4EALDH1A1NPSR1DRD2DRD4 | |
| Hydrochloric Acid SCHEMBL11187904 | 0.72 | LMNA (0.62) | KDM4EALDH1A1NPSR1DRD2DRD4 | |
| SCHEMBL13067685 | 0.72 | NR1H2 (0.58) | KDM4EALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL29998844 | 0.72 | NR1H2 (0.58) | KDM4EALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL30340643 | 0.70 | GAA (0.61) | KDM4EALDH1A1SMN1; SMN2MAPTGAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1935885-A2 | Melanin concentrating hormone receptor ligands : substituted 1-benzyl-4-aryl piperazine analogues. | NEUROGEN CORPORATION (US) | 2008-06-25 | — | — | EP | disclosed |