Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 3/20 | 0.57 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | FAHD1 | Q6P587 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11528888 | 1.00 | CA4 (0.57) | CA4CA1FAHD1LMNAFFAR3 | |
| SCHEMBL29259775 | 0.92 | CA4 (0.64) | CA4CA1FAHD1LMNAFFAR3 | |
| Carbon Monoxide SCHEMBL3007515 | 0.85 | CA4 (0.50) | CA4CA1FAHD1LMNAFFAR3 | |
| SCHEMBL11061049 | 0.80 | CA4 (0.53) | CA4CA1FAHD1LMNAFFAR3 | |
| SCHEMBL11061043 | 0.80 | CA4 (0.53) | CA4CA1FAHD1LMNAFFAR3 | |
| SCHEMBL17222808 | 0.80 | CA4 (0.53) | CA4CA1FAHD1LMNAFFAR3 | |
| Zinc Ion SCHEMBL9442714 | 0.80 | CA4 (0.53) | CA4CA1FAHD1LMNAFFAR3 | |
| Lithium Ion SCHEMBL31502571 | 0.80 | — | — | |
| SCHEMBL30746037 | 0.79 | CA4 (0.53) | CA4CA1FAHD1TSHR | |
| Pyruvate SCHEMBL579148 | 0.78 | CA4 (0.91) | CA4CA1FAHD1LMNAFFAR3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4145558-A | Ester derivatives of ether polycarboxylic acids | LEVER BROTHERS COMPANY (US) | 1979-03-20 | — | — | US | disclosed |
| US-4133960-A | Novel ester derivatives of ether polycarboxylic acids and process for making same | LEVER BROTHERS COMPANY (US) | 1979-01-09 | — | — | US | disclosed |
| US-4058554-A | Novel ester derivatives of ether polycarboxylic acids and process for making same | LEVER BROTHERS COMPANY (US) | 1977-11-15 | — | — | US | disclosed |