Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3402446 | 0.87 | RAB9A (0.47) | CYP2D6CYP2C19CYP1A2CYP2C9TSHR | |
| SCHEMBL3399610 | 0.86 | CACNA1G (0.52) | RAB9ANPC1THRBHSD17B10CACNA1G | |
| SCHEMBL3401247 | 0.85 | PPARD (0.48) | CYP2D6CYP2C19CYP1A2CYP2C9TSHR | |
| SCHEMBL3403830 | 0.85 | HTR3A (0.47) | MAPTALDH1A1L3MBTL1 | |
| SCHEMBL3399723 | 0.84 | HSD17B10 (0.51) | CYP2D6CYP2C19CYP1A2CYP2C9TSHR | |
| SCHEMBL3402499 | 0.84 | CYP1A2 (0.53) | CYP2D6CYP2C19CYP1A2CYP2C9TSHR | |
| SCHEMBL3405436 | 0.83 | CACNA1G (0.49) | RAB9ANPC1THRBCACNA1GLMNA | |
| SCHEMBL3406018 | 0.82 | HSD17B10 (0.49) | CYP2D6CYP2C19CYP1A2CYP2C9TSHR | |
| SCHEMBL3400138 | 0.82 | HSD17B10 (0.53) | CYP2D6CYP2C19CYP1A2CYP2C9TSHR | |
| SCHEMBL3399710 | 0.82 | THRB (0.54) | CYP2D6CYP2C19CYP1A2CYP2C9TSHR |
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 |
|---|---|---|---|---|---|---|---|
| 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 |