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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL23363665 | 0.95 | TSHR (0.36) | — | |
| Diethanolamine SCHEMBL8930798 | 0.95 | TSHR (0.36) | — | |
| Diethanolamine SCHEMBL2324 | 0.95 | — | — | |
| Diethanolamine SCHEMBL5843119 | 0.95 | — | — | |
| Diethanolamine SCHEMBL5307430 | 0.95 | TSHR (0.36) | — | |
| Diethanolamine SCHEMBL9448596 | 0.91 | — | — | |
| Diethanolamine SCHEMBL1584965 | 0.91 | — | — | |
| Diethanolamine SCHEMBL4338732 | 0.91 | — | — | |
| Diethanolamine SCHEMBL18916924 | 0.91 | — | — | |
| Diethanolamine SCHEMBL922879 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110236838-A1 | COLOR PHOTOGRAPHIC MATERIALS WITH IMPROVED BLUE SENSITIZATION | CITICORP NORTH AMERICA, INC., AS AGENT | 2011-09-29 | — | — | US | disclosed |
| US-4157262-A | Intensification of photographic silver images by physical development and improvement in physical developer solution for use therein | FUJI PHOTO FILM CO., LTD. (JP) | 1979-06-05 | — | — | US | disclosed |