Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.52 |
| ▸ | DRD2 | P14416 | 8/20 | 0.50 |
| ▸ | DRD4 | P21917 | 8/20 | 0.50 |
| ▸ | DRD3 | P35462 | 8/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | GPR6 | P46095 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4075730 | 0.74 | HTR2B (0.60) | DRD2DRD4DRD3HTR1A | |
| SCHEMBL5763082 | 0.74 | MAOB (0.50) | KDM4ESMN1; SMN2 | |
| SCHEMBL1750627 | 0.74 | SIGMAR1 (0.58) | SIGMAR1DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL1387431 | 0.73 | ALDH1A1 (0.62) | SIGMAR1DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL13772456 | 0.73 | SIGMAR1 (0.58) | SIGMAR1DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL28262836 | 0.71 | ALDH1A1 (0.57) | SIGMAR1DRD2DRD4DRD3ALDH1A1 | |
| SCHEMBL5762073 | 0.71 | MAOB (0.53) | KDM4E | |
| SCHEMBL4074069 | 0.70 | MEN1 (0.60) | ALDH1A1KDM4EHTR1ASMN1; SMN2TSHR | |
| SCHEMBL4072689 | 0.69 | ALDH1A1 (0.70) | ALDH1A1KDM4EHSD17B10TSHRHTR7 | |
| SCHEMBL7295692 | 0.69 | SIGMAR1 (1.00) | SIGMAR1ALDH1A1HSD17B10HTR1ATSHR |
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-1745010-B1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2009-08-05 | — | — | EP | claimed |