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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 4/20 | 0.54 |
| ▸ | GABBR1 | Q9UBS5 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ANPEP | P15144 | 4/20 | 0.39 |
| ▸ | LAP3 | P28838 | 4/20 | 0.39 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.39 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 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 | |
|---|---|---|---|---|
| SCHEMBL10437673 | 0.89 | GABBR2 (0.44) | GABBR2GABBR1ALDH1A1ANPEPLAP3 | |
| SCHEMBL624045 | 0.89 | GABBR2 (0.44) | GABBR2GABBR1ALDH1A1ANPEPLAP3 | |
| Ethylenediamine SCHEMBL11317942 | 0.78 | ALDH1A1 (0.50) | GABBR2GABBR1ALDH1A1ANPEPLAP3 | |
| SCHEMBL15022505 | 0.77 | — | — | |
| SCHEMBL182938 | 0.76 | — | — | |
| SCHEMBL6615334 | 0.72 | — | — | |
| SCHEMBL366378 | 0.70 | — | — | |
| SCHEMBL19212086 | 0.70 | ANPEP (0.39) | GABBR2GABBR1ALDH1A1ANPEPLAP3 | |
| SCHEMBL341418 | 0.70 | — | — | |
| SCHEMBL16168095 | 0.69 | LAP3 (0.48) | GABBR2GABBR1ALDH1A1ANPEPLAP3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7077895-B2 | Coating compound for forming titanium oxide film, method for forming titanium oxide film and metal susbstrate coated with titanium oxide film | KANSAI PAINT CO., LTD. (JP) | 2006-07-18 | — | — | US | disclosed |
| US-20050205165-A1 | Coating composition for forming titanium oxide film, process for forming titanium oxide film and metal substrate coated with titanium oxide film | KANSAIPAINT CO., LTD. (JP) | 2005-09-22 | — | — | US | disclosed |
| US-20040244648-A1 | Coating compound for forming titanium oxide film, method for forming titanium oxide film and metal substrate coated with titanium oxide film | KANSAI PAINT CO., LTD. (JP) | 2004-12-09 | — | — | US | disclosed |
| EP-1449891-A1 | COATING COMPOUND FOR FORMING TITANIUM OXIDE FILM, METHOD FOR FORMING TITANIUM OXIDE FILM AND METAL SUBSTRATE COATED WITH TITANIUM OXIDE FILM | KANSAI PAINT CO., LTD. (JP) | 2004-08-25 | — | — | EP | disclosed |