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.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | EYA2 | O00167 | 1/20 | 0.52 |
| ▸ | APP | P05067 | 1/20 | 0.52 |
| ▸ | ACE | P12821 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 5/20 | 0.50 |
| ▸ | BLM | P54132 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.50 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | DRD1 | P21728 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Edetic Acid SCHEMBL1834374 | 0.90 | TDP1 (0.70) | TDP1EYA2APPACETSHR | |
| Edetic Acid SCHEMBL5933950 | 0.90 | TDP1 (0.70) | TDP1EYA2APPACETSHR | |
| Nitrilotriacetic Acid SCHEMBL19893757 | 0.88 | TDP1 (0.58) | TDP1EYA2APPACETSHR | |
| Pentetic Acid SCHEMBL9278857 | 0.87 | TDP1 (0.71) | TDP1EYA2APPACETSHR | |
| Nitrilotriacetic Acid SCHEMBL21296993 | 0.84 | TDP1 (0.54) | TDP1EYA2APPACETSHR | |
| Nitrilotriacetic Acid SCHEMBL4015790 | 0.82 | GLRA1 (0.62) | TDP1EYA2APPACETSHR | |
| SCHEMBL783967 | 0.82 | TDP1 (0.65) | TDP1EYA2APPACETSHR | |
| Nitrilotriacetic Acid SCHEMBL670055 | 0.82 | TDP1 (0.73) | TDP1EYA2APPACETSHR | |
| Nitrilotriacetic Acid SCHEMBL9771757 | 0.82 | TDP1 (0.73) | TDP1EYA2APPACETSHR | |
| Nitrilotriacetic Acid SCHEMBL20409 | 0.82 | TDP1 (0.73) | TDP1EYA2APPACETSHR |
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-105944735-A | Activating method of II type hydrogenation catalyst with carbon deposit inactivation | 盘锦鑫安源化学工业有限公司 | 2016-09-21 | — | — | CN | claimed |
| CN-105944735-A | Activating method of II type hydrogenation catalyst with carbon deposit inactivation | 盘锦鑫安源化学工业有限公司 | 2016-09-21 | — | — | CN | disclosed |