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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PAOX | Q6QHF9 | 2/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 SCHEMBL2405576 | 1.00 | TGFBR1 (0.38) | TGFBR1KDM4EALDH1A1SMN1; SMN2HTT | |
| Methacrylic Acid SCHEMBL28840208 | 0.89 | TGFBR1 (0.34) | TGFBR1KDM4EALDH1A1POLBMEN1 | |
| Diethanolamine SCHEMBL1837947 | 0.84 | KDM4E (0.39) | KDM4EALDH1A1SMN1; SMN2HTTLMNA | |
| Diethanolamine SCHEMBL9790976 | 0.84 | FFAR3 (0.44) | KDM4EALDH1A1SMN1; SMN2HTTLMNA | |
| Diethanolamine SCHEMBL502768 | 0.84 | FFAR3 (0.44) | KDM4EALDH1A1SMN1; SMN2HTTLMNA | |
| Methacrylic Acid SCHEMBL31412761 | 0.83 | PAOX (0.51) | SMN1; SMN2LMNAMEN1KMT2APAOX | |
| Acetic Acid SCHEMBL3929709 | 0.81 | FYN (0.41) | KDM4EALDH1A1SMN1; SMN2HTTLMNA | |
| Acetic Acid SCHEMBL3841810 | 0.81 | FYN (0.41) | KDM4EALDH1A1SMN1; SMN2HTTLMNA | |
| Diethanolamine SCHEMBL3630770 | 0.81 | FFAR3 (0.41) | KDM4EALDH1A1SMN1; SMN2HTTLMNA | |
| Diethanolamine SCHEMBL29053961 | 0.81 | FFAR3 (0.41) | KDM4EALDH1A1SMN1; SMN2HTTLMNA |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11602490-B2 | One pack-type dental adhesive composition | SHOFU INC. (JP) | 2023-03-14 | — | — | US | disclosed |
| WO-2022220250-A1 | DENTAL FILLING KIT | クラレノリタケデンタル株式会社 | 2022-10-20 | — | — | WO | disclosed |
| US-20220008314-A1 | DENTAL CLEANER AND DENTAL REMOVER FOR TEMPORARY ADHESIVES | KURARAY NORITAKE DENTAL INC. (JP) | 2022-01-13 | — | — | US | disclosed |
| EP-3884920-A1 | DENTAL CLEANING MATERIAL AND DENTAL TEMPORARY ADHESIVE MATERIAL REMOVAL MATERIAL | Kuraray Noritake Dental Inc. (JP) | 2021-09-29 | — | — | EP | disclosed |
| US-20210205181-A1 | ONE PACK-TYPE DENTAL ADHESIVE COMPOSITION | SHOFU INC. (JP) | 2021-07-08 | — | — | US | disclosed |
| WO-2021132463-A1 | DENTAL RESTORATION MATERIAL COMPOSITION | クラレノリタケデンタル株式会社 | 2021-07-01 | — | — | WO | disclosed |
| EP-3804688-A1 | ONE PACK-TYPE DENTAL ADHESIVE COMPOSITION | Shofu Inc. (JP) | 2021-04-14 | — | — | EP | disclosed |
| CN-110325167-A | Gear division curable composition | 株式会社GC | 2019-10-11 | — | — | CN | disclosed |
| US-6364465-B1 | PRIOR TO IMAGING TO FORM SAID INK PASSAGEWAYS, COMPRISES AN UNSATURATED COMPOUND, A PHOTOINITIATOR, AND THE POLY(AMIC ACID) PREPARED FROM AT LEAST ONE DIANHYDRIDE AND AT LEAST ONE ALIPHATIC DIAMINE. | E. I. DU PONT DE NEMOURS AND COMPANY | 2002-04-02 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20210205181-A1 | ONE PACK-TYPE DENTAL ADHESIVE COMPOSITION | ITGA1, TAS2R1, ITGB1 | TGFBR1 2034/4885KDM4E 1664/4885ALDH1A1 330/4885 |
| US-11602490-B2 | One pack-type dental adhesive composition | ITGA1, TAS2R1, ITGB1 | TGFBR1 2034/4885KDM4E 1664/4885ALDH1A1 330/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.