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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGKA | P23743 | 1/20 | 0.65 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.55 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.55 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.55 |
| ▸ | NAAA | Q02083 | 1/20 | 0.55 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.54 |
| ▸ | HTR2C | P28335 | 1/20 | 0.53 |
| ▸ | PAM | P19021 | 2/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.50 |
| ▸ | FAAH | O00519 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL19032585 | 0.97 | DGKA (0.61) | DGKAPRSS1PRSS2PRSS3NAAA | |
| SCHEMBL19032459 | 0.97 | DGKA (0.61) | DGKAPRSS1PRSS2PRSS3NAAA | |
| SCHEMBL31399579 | 0.97 | DGKA (0.61) | DGKAPRSS1PRSS2PRSS3NAAA | |
| SCHEMBL31036510 | 0.97 | DGKA (0.61) | DGKAPRSS1PRSS2PRSS3NAAA | |
| SCHEMBL18641884 | 0.97 | DGKA (0.61) | DGKAPRSS1PRSS2PRSS3NAAA | |
| SCHEMBL31399531 | 0.97 | DGKA (0.61) | DGKAPRSS1PRSS2PRSS3NAAA | |
| SCHEMBL16389896 | 0.93 | DGKA (0.65) | DGKAPRSS1PRSS2PRSS3NAAA | |
| SCHEMBL13525156 | 0.93 | DGKA (0.65) | DGKAPRSS1PRSS2PRSS3NAAA | |
| SCHEMBL16390368 | 0.93 | DGKA (0.65) | DGKAPRSS1PRSS2PRSS3NAAA | |
| SCHEMBL973717 | 0.93 | DGKA (0.65) | DGKAPRSS1PRSS2PRSS3NAAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-104975494-A | Chinlon DTY oiling agent with efficient permeability and splashing prevention property and preparation method of oiling agent | TAICANG LONGFANG OIL AGENT CO LTD | 2015-10-14 | — | — | CN | claimed |
| CN-104975494-A | Chinlon DTY oiling agent with efficient permeability and splashing prevention property and preparation method of oiling agent | TAICANG LONGFANG OIL AGENT CO LTD | 2015-10-14 | — | — | CN | disclosed |