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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | LDHA | P00338 | 1/20 | 0.37 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.37 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | TYMP | P19971 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 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 SCHEMBL1682232 | 0.85 | LDHA (0.39) | TSHRKDM4EALDH1A1LDHASRR | |
| Malonic Acid SCHEMBL5875293 | 0.85 | LDHA (0.56) | TSHRKDM4EALDH1A1LDHASRR | |
| Diethanolamine SCHEMBL1833343 | 0.84 | KDM4E (0.39) | TSHRKDM4EALDH1A1LDHASRR | |
| Diethanolamine SCHEMBL1832822 | 0.84 | KDM4E (0.39) | TSHRKDM4EALDH1A1LDHASRR | |
| Succinic Acid SCHEMBL18492331 | 0.82 | EGLN1 (0.53) | TSHRKDM4ELDHASRRCAMK2A | |
| Succinic Acid SCHEMBL1832868 | 0.82 | EGLN1 (0.53) | TSHRKDM4ELDHASRRCAMK2A | |
| Bicarbonate SCHEMBL4329497 | 0.81 | SMN1; SMN2 (0.39) | KDM4EALDH1A1LDHASRRCAMK2A | |
| Diethanolamine SCHEMBL1834267 | 0.81 | KDM4E (0.47) | KDM4EALDH1A1LDHASRRMEN1 | |
| Diethanolamine SCHEMBL30231435 | 0.81 | KDM4E (0.38) | TSHRKDM4EALDH1A1LDHASRR | |
| Diethanolamine SCHEMBL1401642 | 0.81 | KDM4E (0.47) | KDM4EALDH1A1LDHASRRMEN1 |
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-7128976-B2 | Composition for film formation, method of film formation, and silica-based film | JSR CORPORATION (JP) | 2006-10-31 | — | — | US | disclosed |
| US-20030091838-A1 | Composition for film formation, method of film formation, and silica-based film | JSR CORPORATION (JP) | 2003-05-15 | — | — | US | disclosed |