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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 4/20 | 0.43 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28836796 | 0.96 | KCNN4 (0.41) | KIF11KCNN4TAAR1CHRM3KMT2A | |
| SCHEMBL21656187 | 0.80 | KCNN4 (0.58) | KCNN4TAAR1KMT2AMEN1MAPT | |
| SCHEMBL9516972 | 0.77 | PIN1 (0.50) | KCNN4TAAR1CHRM3CHRM2CHRM1 | |
| SCHEMBL5275267 | 0.77 | CYP2C19 (0.46) | KIF11KCNN4TAAR1CHRM3CHRM2 | |
| SCHEMBL14510428 | 0.77 | PIN1 (0.50) | KCNN4TAAR1CHRM3CHRM2CHRM1 | |
| SCHEMBL7401352 | 0.77 | CYP1A2 (0.46) | KIF11KCNN4TAAR1KMT2AALDH1A1 | |
| SCHEMBL6893556 | 0.76 | TSHR (0.49) | CHRM3CHRM2CHRM1KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL21632081 | 0.75 | CYP1A2 (0.45) | KIF11KCNN4TAAR1KMT2AALDH1A1 | |
| SCHEMBL9513234 | 0.72 | KCNN4 (0.47) | KCNN4CHRM3CHRM2CHRM1KMT2A | |
| Ethylenediamine SCHEMBL2494997 | 0.71 | KIF11 (0.45) | KIF11TAAR1KMT2AALDH1A1MAPT |
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-106232150-A | Comprise the hygienic articles of effective odor-control system | 安泰士有限公司 | 2016-12-14 | — | — | CN | claimed |
| CN-106232150-A | Comprise the hygienic articles of effective odor-control system | 安泰士有限公司 | 2016-12-14 | — | — | CN | disclosed |