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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.37 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8588712 | 0.88 | LTB4R (0.40) | CYP2D6SLC6A2SLC6A4HTR2BLTB4R | |
| SCHEMBL5019356 | 0.71 | HTR2A (0.48) | CYP2D6SLC6A2SLC6A4HTR2BPOLB | |
| SCHEMBL97554 | 0.71 | ITGB2 (0.41) | HTR2A | |
| SCHEMBL7022979 | 0.71 | CYP19A1 (0.32) | CYP19A1 | |
| SCHEMBL21979154 | 0.68 | PPARG (0.49) | POLBALDH1A1 | |
| SCHEMBL10653261 | 0.68 | TRPV1 (0.40) | CYP2D6 | |
| SCHEMBL2688677 | 0.67 | LTB4R (0.44) | CYP2D6SLC6A2SLC6A4HTR2BLTB4R | |
| SCHEMBL19574896 | 0.67 | LTB4R (0.44) | CYP2D6SLC6A2SLC6A4HTR2BLTB4R | |
| SCHEMBL14367878 | 0.67 | PSMB5 (0.42) | CYP2D6SLC6A2SLC6A4LTB4RLTB4R2 | |
| SCHEMBL29138532 | 0.67 | PPARG (0.42) | SLC6A2SLC6A4LTB4RLTB4R2CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109988560-B | Novel coumarin derivative hydrazine fluorescent probe | 济南大学 | 2020-09-29 | — | — | CN | disclosed |
| CN-108129435-B | Novel iron ion fluorescent probe and preparation method thereof | 济南大学 | 2020-09-08 | — | — | CN | disclosed |