Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Nitrilotriacetic Acid. 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 | |
|---|---|---|---|---|
| Nitrilotriacetic Acid SCHEMBL3796808 | 0.94 | — | — | |
| Nitrilotriacetic Acid SCHEMBL3865107 | 0.94 | — | — | |
| Diethylamine SCHEMBL5809609 | 0.91 | SMN1; SMN2 (0.31) | — | |
| Edetic Acid SCHEMBL3802209 | 0.90 | TDP1 (0.32) | — | |
| Pentetic Acid SCHEMBL3802223 | 0.89 | TDP1 (0.33) | — | |
| Edetic Acid SCHEMBL4161685 | 0.85 | — | — | |
| Edetic Acid SCHEMBL4712277 | 0.85 | — | — | |
| Pentetic Acid SCHEMBL4709760 | 0.84 | KDM4E (0.31) | — | |
| Pentetic Acid SCHEMBL4158513 | 0.84 | KDM4E (0.31) | — | |
| Nitrilotriacetic Acid SCHEMBL3801112 | 0.79 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8216596-B2 | 4-Hydroxy-1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidine, citric acid and a body care product; hindered amine salt compounds provide outstanding protection against light-induced fading | BASF SE (DE) | 2012-07-10 | — | — | US | claimed |
| US-20060262149-A1 | Ink jet ink and recording material | WOOD MERVIN G | 2006-11-23 | — | — | US | claimed |
| US-20060264345-A1 | Stabilized body care products, household products, textiles and fabrics | BASF SE (DE) | 2006-11-23 | — | — | US | claimed |
| EP-2207522-B1 | PERSONAL CARE AND HOUSEHOLD PRODUCT COMPOSITIONS COMPRISING SPECIFIC SULFUR CONTAINING STABILISER COMPOUNDS | BASF SE (DE) | 2019-11-06 | — | — | EP | disclosed |
| US-8216596-B2 | 4-Hydroxy-1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidine, citric acid and a body care product; hindered amine salt compounds provide outstanding protection against light-induced fading | BASF SE (DE) | 2012-07-10 | — | — | US | disclosed |
| US-20090092561-A1 | Body-care and household products and compositions comprising specific sulfur-containing compounds | BASF SE (DE) | 2009-04-09 | — | — | US | disclosed |
| US-20060262149-A1 | Ink jet ink and recording material | WOOD MERVIN G | 2006-11-23 | — | — | US | disclosed |
| US-20060264345-A1 | Stabilized body care products, household products, textiles and fabrics | BASF SE (DE) | 2006-11-23 | — | — | US | disclosed |