Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | DRD4 | P21917 | 7/20 | 0.44 |
| ▸ | DRD2 | P14416 | 4/20 | 0.44 |
| ▸ | DRD3 | P35462 | 4/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TRPV6 | Q9H1D0 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3405212 | 0.98 | SIGMAR1 (0.49) | SIGMAR1DRD4DRD2DRD3CYP2D6 | |
| SCHEMBL3405477 | 0.91 | SIGMAR1 (0.42) | SIGMAR1DRD4DRD2DRD3CYP2D6 | |
| SCHEMBL3400917 | 0.90 | ALDH1A1 (0.46) | SIGMAR1DRD4DRD2DRD3CYP2D6 | |
| SCHEMBL3404406 | 0.90 | SIGMAR1 (0.43) | SIGMAR1DRD4DRD2DRD3CYP2D6 | |
| SCHEMBL3405592 | 0.86 | CYP2D6 (0.47) | SIGMAR1DRD4DRD2DRD3CYP2D6 | |
| SCHEMBL3403856 | 0.86 | DRD4 (0.43) | SIGMAR1DRD4DRD2DRD3CYP2D6 | |
| SCHEMBL3399872 | 0.84 | CYP2D6 (0.47) | SIGMAR1DRD4DRD2DRD3CYP2D6 | |
| SCHEMBL3400725 | 0.84 | ALDH1A1 (0.43) | SIGMAR1DRD4DRD2DRD3CYP2D6 | |
| SCHEMBL3400861 | 0.82 | SIGMAR1 (0.43) | SIGMAR1DRD4DRD3ALDH1A1TP53 | |
| SCHEMBL3397927 | 0.82 | DRD4 (0.46) | SIGMAR1DRD4DRD2DRD3CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7728009-B1 | Thiazole amides, imidazole amides and related analogues | NEUROGEN CORPORATION (US) | 2010-06-01 | — | — | US | disclosed |
| US-7728009-B1 | Thiazole amides, imidazole amides and related analogues | NEUROGEN CORPORATION (US) | 2010-06-01 | — | — | US | disclosed |
| US-7728009-B1 | Thiazole amides, imidazole amides and related analogues | NEUROGEN CORPORATION (US) | 2010-06-01 | — | — | US | disclosed |
| WO-2006089076-A9 | THIAZOLE AMIDES, IMIDAZOLE AMIDES AND RELATED ANALOGUES | NEUROGEN CORP (US) | 2007-04-26 | — | — | WO | disclosed |