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 | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.52 |
| ▸ | RRM1 | P23921 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | PLG | P00747 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 6/20 | 0.45 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.45 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.45 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.45 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.45 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8390709 | 0.95 | ADRA1A (0.58) | ADRA1APRMT1ALDH1A1LMNAEPHX2 | |
| SCHEMBL8388348 | 0.93 | ADRA1A (0.55) | ADRA1APRMT1LMNAEPHX2PLA2G2A | |
| SCHEMBL27765049 | 0.88 | ADRA1A (0.47) | ADRA1APRMT1EPHX2DPP7TLR2 | |
| SCHEMBL8389957 | 0.88 | ADRA1A (0.47) | ADRA1APRMT1EPHX2DPP7TLR2 | |
| SCHEMBL15623802 | 0.84 | GNAI3 (0.60) | RRM1ALDH1A1GNAI3GNAO1GNAI1 | |
| SCHEMBL15623812 | 0.84 | ALDH1A2 (0.54) | RRM1ALDH1A1GNAI3GNAO1GNAI1 | |
| SCHEMBL8350906 | 0.82 | GNAI3 (0.57) | RRM1ALDH1A1GNAI3GNAO1GNAI1 | |
| SCHEMBL24977872 | 0.82 | ADRA1A (0.51) | ADRA1APRMT1RRM1MEN1ALDH1A1 | |
| SCHEMBL27267263 | 0.82 | ADRA1A (0.51) | ADRA1APRMT1RRM1MEN1ALDH1A1 | |
| SCHEMBL23071875 | 0.81 | ADRA1A (0.47) | ADRA1APRMT1EPHX2PLA2G2AMAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0542770-A4 | RANDOM BIO-OLIGOMER LIBRARY, A METHOD OF SYNTHESIS THEREOF, AND A METHOD OF USE THEREOF | — | 1993-09-15 | — | — | EP | disclosed |
| EP-0542770-A1 | RANDOM BIO-OLIGOMER LIBRARY, A METHOD OF SYNTHESIS THEREOF, AND A METHOD OF USE THEREOF | ARIZONA BOARD OF REGENTS a body corporate acting on behalf of Arizona State University (US) | 1993-05-26 | — | — | EP | disclosed |
| WO-1992000091-A1 | RANDOM BIO-OLIGOMER LIBRARY, A METHOD OF SYNTHESIS THEREOF, AND A METHOD OF USE THEREOF | BIOLIGAND, INC. (US) | 1992-01-09 | — | — | WO | disclosed |