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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | TP53 | P04637 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | USP2 | O75604 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| Diethanolamine SCHEMBL1584965 | 1.00 | — | — | |
| Diethanolamine SCHEMBL28298473 | 0.96 | SMN1; SMN2 (0.33) | SMN1; SMN2TSHRTP53CYP1A2CYP2D6 | |
| Diethanolamine SCHEMBL27754221 | 0.96 | — | — | |
| Diethanolamine SCHEMBL23363665 | 0.95 | TSHR (0.36) | SMN1; SMN2TSHRTP53CYP1A2CYP2D6 | |
| Diethanolamine SCHEMBL8930798 | 0.95 | TSHR (0.36) | SMN1; SMN2TSHRTP53CYP1A2CYP2D6 | |
| Diethanolamine SCHEMBL2324 | 0.95 | — | — | |
| Diethanolamine SCHEMBL5307430 | 0.95 | TSHR (0.36) | SMN1; SMN2TSHRTP53CYP1A2CYP2D6 | |
| Diethanolamine SCHEMBL5843119 | 0.95 | — | — | |
| Diethanolamine SCHEMBL18916924 | 0.91 | — | — | |
| Diethanolamine SCHEMBL19439562 | 0.91 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-112844436-B | Catalyst for removing formaldehyde and carbon monoxide by catalysis and preparation method thereof | 宁波方太厨具有限公司 | 2022-05-17 | — | — | CN | disclosed |