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 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.69 |
| ▸ | TSHR | P16473 | 4/20 | 0.69 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 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 | |
|---|---|---|---|---|
| SCHEMBL197951 | 0.98 | ALDH1A1 (0.72) | ALDH1A1CYP3A4TSHRTDP1KDM4E | |
| Hydrochloric Acid SCHEMBL28431270 | 0.96 | ALDH1A1 (0.69) | ALDH1A1CYP3A4TSHRTDP1KDM4E | |
| SCHEMBL4908682 | 0.94 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRTDP1KDM4E | |
| SCHEMBL4917085 | 0.94 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRTDP1KDM4E | |
| SCHEMBL4914031 | 0.94 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRTDP1KDM4E | |
| SCHEMBL197248 | 0.90 | ALDH1A1 (0.67) | ALDH1A1CYP3A4TSHRTDP1KDM4E | |
| SCHEMBL29057251 | 0.89 | ALDH1A1 (0.60) | ALDH1A1CYP3A4TSHRTDP1KDM4E | |
| SCHEMBL20145257 | 0.88 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TSHRTDP1KDM4E | |
| Propylamine SCHEMBL19834934 | 0.88 | TSHR (0.83) | ALDH1A1CYP3A4TSHRTDP1KDM4E | |
| SCHEMBL4909383 | 0.87 | TSHR (0.82) | ALDH1A1CYP3A4TSHRTDP1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1914254-A1 | Crosslinkers for improving stability of polyurethane foams | Air Products and Chemicals, Inc. (US) | 2008-04-23 | — | — | EP | claimed |