Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D
The experimentally established mechanism targets of Ethylenediamine. 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 | |
|---|---|---|---|---|
| ▸ | ADORA3 known ✓ | P0DMS8 | 2/20 | 0.53 |
| ▸ | ADORA2A known ✓ | P29274 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 4/20 | 0.70 |
| ▸ | MAOA | P21397 | 1/20 | 0.65 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.62 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.55 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 2/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.53 |
| ▸ | TACR2 | P21452 | 2/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | SHBG | P04278 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Propylamine SCHEMBL8977021 | 0.96 | HTR2A (0.70) | HTR2AMAOAKCNH2SIGMAR1CYP2A6 | |
| Butylamine SCHEMBL27594153 | 0.94 | MAOA (0.69) | HTR2AMAOAKCNH2SIGMAR1CYP2A6 | |
| Butylamine SCHEMBL23671987 | 0.94 | MAOA (0.69) | HTR2AMAOAKCNH2SIGMAR1CYP2A6 | |
| Propylamine SCHEMBL8976772 | 0.94 | MAOA (0.68) | HTR2AMAOAKCNH2SIGMAR1CYP2A6 | |
| SCHEMBL8091280 | 0.92 | MAOA (0.72) | HTR2AMAOAKCNH2SIGMAR1CYP2A6 | |
| 4-Phenyl-Butylamine SCHEMBL9373863 | 0.92 | MAOA (0.79) | HTR2AMAOAKCNH2SIGMAR1CYP2A6 | |
| 4-Phenyl-Butylamine SCHEMBL8343768 | 0.92 | MAOA (0.79) | HTR2AMAOAKCNH2SIGMAR1CYP2A6 | |
| Methylamine SCHEMBL27596716 | 0.91 | KCNH2 (0.67) | HTR2AMAOAKCNH2SIGMAR1ESR1 | |
| Methylamine SCHEMBL27712583 | 0.91 | KCNH2 (0.67) | HTR2AMAOAKCNH2SIGMAR1ESR1 | |
| Methylamine SCHEMBL28118971 | 0.91 | KCNH2 (0.67) | HTR2AMAOAKCNH2SIGMAR1ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108777966-B | Granular pesticide composition and preparation method thereof | 组合化学工业株式会社 | 2020-06-30 | — | — | CN | disclosed |