Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Diethanolamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8989707 | 0.82 | TDP1 (0.56) | TDP1ROCK2 | |
| Hydrochloric Acid SCHEMBL9137032 | 0.80 | TDP1 (0.53) | TDP1 | |
| Thiodiglycol SCHEMBL10534858 | 0.79 | TDP1 (1.00) | TDP1ROCK2TSHR | |
| Diethanolamine SCHEMBL5843119 | 0.79 | — | — | |
| Diethanolamine SCHEMBL8930798 | 0.79 | TSHR (0.36) | TDP1KDM4EALDH1A1TSHR | |
| Diethanolamine SCHEMBL23363665 | 0.79 | TSHR (0.36) | TDP1KDM4EALDH1A1TSHR | |
| Diethanolamine SCHEMBL2324 | 0.79 | — | — | |
| Diethanolamine SCHEMBL5307430 | 0.79 | TSHR (0.36) | TDP1KDM4EALDH1A1TSHR | |
| Thiodiglycol SCHEMBL40132 | 0.79 | — | — | |
| SCHEMBL11544048 | 0.78 | TDP1 (0.36) | TDP1KDM4EALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-6482501-B2 | Optical-use adhesive film | TOYO BOSEKI KABUSHIKI KAISHA (JP) | 2002-11-19 | — | — | US | disclosed |
| US-20020098344-A1 | OPTICAL-USE ADHESIVE FILM | TOYO BOSEKI KABUSHIKI KAISHA (JP) | 2002-07-25 | — | — | US | disclosed |