Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Diethylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 8/20 | 0.69 |
| ▸ | HTR2B | P41595 | 8/20 | 0.69 |
| ▸ | PLK4 | O00444 | 1/20 | 0.54 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.54 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.54 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.54 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.54 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.54 |
| ▸ | CDK1 | P06493 | 1/20 | 0.54 |
| ▸ | PIM1 | P11309 | 1/20 | 0.54 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.54 |
| ▸ | CDK2 | P24941 | 1/20 | 0.54 |
| ▸ | FLT4 | P35916 | 1/20 | 0.54 |
| ▸ | KDR | P35968 | 1/20 | 0.54 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.54 |
| ▸ | CDK8 | P49336 | 1/20 | 0.54 |
| ▸ | CLK2 | P49760 | 1/20 | 0.54 |
| ▸ | GSK3A | P49840 | 1/20 | 0.54 |
| ▸ | GSK3B | P49841 | 1/20 | 0.54 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Dimethylamine SCHEMBL7661486 | 0.90 | HTR2C (0.70) | HTR2CHTR2BPLK4CHEK1PDPK1 | |
| SCHEMBL3807061 | 0.89 | HTR2C (0.73) | HTR2CHTR2BPLK4CHEK1PDPK1 | |
| Dimethylamine SCHEMBL7660199 | 0.88 | HTR2C (0.72) | HTR2CHTR2BPLK4CHEK1PDPK1 | |
| Hydrochloric Acid SCHEMBL7658380 | 0.86 | HTR2C (0.69) | HTR2CHTR2BPLK4CHEK1PDPK1 | |
| SCHEMBL7373725 | 0.84 | HTR2C (0.74) | HTR2CHTR2BPLK4CHEK1PDPK1 | |
| Hydrochloric Acid SCHEMBL7402222 | 0.83 | HTR2C (0.98) | HTR2CHTR2BPLK4CHEK1PDPK1 | |
| SCHEMBL27579461 | 0.82 | PLK4 (0.73) | HTR2CHTR2BPLK4CHEK1PDPK1 | |
| Hydrochloric Acid SCHEMBL7653195 | 0.82 | HTR2C (0.74) | HTR2CHTR2BPLK4CHEK1PDPK1 | |
| SCHEMBL7447703 | 0.81 | HTR2C (0.71) | HTR2CHTR2BPLK4CHEK1PDPK1 | |
| Hydrochloric Acid SCHEMBL7658715 | 0.81 | HTR2C (0.66) | HTR2CHTR2BPLK4CHEK1PDPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6410529-B1 | DIETETICS; NON-INSULIN DEPENDENT DIABETES; SLEEP DISORDERS | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-06-25 | — | — | US | disclosed |