Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Trolamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Trolamine SCHEMBL27786163 | 0.95 | SMN1; SMN2 (0.46) | SMN1; SMN2KDM4EMAPTALOX15MEN1 | |
| Trolamine SCHEMBL27804709 | 0.90 | SMN1; SMN2 (0.43) | SMN1; SMN2KDM4EMAPTALOX15MEN1 | |
| Trolamine SCHEMBL8083438 | 0.89 | TP53 (0.41) | SMN1; SMN2KDM4EMAPTALOX15MEN1 | |
| Trolamine SCHEMBL8447470 | 0.89 | TP53 (0.41) | SMN1; SMN2KDM4EMAPTALOX15MEN1 | |
| Trolamine SCHEMBL28031872 | 0.89 | TP53 (0.41) | SMN1; SMN2KDM4EMAPTALOX15MEN1 | |
| Trolamine SCHEMBL4654746 | 0.89 | CA5A (0.40) | SMN1; SMN2KDM4EMAPTALOX15MEN1 | |
| Trolamine SCHEMBL3843888 | 0.89 | CA5A (0.40) | SMN1; SMN2KDM4EMAPTALOX15MEN1 | |
| Trolamine SCHEMBL248272 | 0.89 | CA5A (0.40) | SMN1; SMN2KDM4EMAPTALOX15MEN1 | |
| Trolamine SCHEMBL17673124 | 0.86 | MEN1 (0.42) | SMN1; SMN2KDM4EMAPTALOX15MEN1 | |
| Trolamine SCHEMBL28211900 | 0.86 | SMN1; SMN2 (0.39) | SMN1; SMN2KDM4EMAPTALOX15TP53 |
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-106007472-B | For the composite water-reducing agent of slag powders mountain flour large dosage double-admixing concrete | 十九冶成都建设有限公司 | 2018-06-29 | — | — | CN | disclosed |