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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MLNR | O43193 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5884144 | 0.89 | KCNH2 (0.53) | KCNH2HTTNR1I2LMNAHIF1A | |
| SCHEMBL4539898 | 0.89 | KCNH2 (0.53) | KCNH2HTTNR1I2LMNAHIF1A | |
| SCHEMBL330793 | 0.89 | NR1I2 (0.47) | KCNH2HTTMEN1KMT2ANR1I2 | |
| SCHEMBL331265 | 0.89 | NR1I2 (0.47) | KCNH2HTTMEN1KMT2ANR1I2 | |
| SCHEMBL330813 | 0.89 | NR1I2 (0.47) | KCNH2HTTMEN1KMT2ANR1I2 | |
| SCHEMBL330562 | 0.89 | NR1I2 (0.47) | KCNH2HTTMEN1KMT2ANR1I2 | |
| SCHEMBL5884129 | 0.86 | SMN1; SMN2 (0.43) | KCNH2HTTMEN1KMT2ANR1I2 | |
| SCHEMBL5883912 | 0.86 | NR1I2 (0.47) | KCNH2HTTNR1I2LMNAHIF1A | |
| SCHEMBL4891799 | 0.86 | NR1I2 (0.47) | KCNH2HTTNR1I2LMNAHIF1A | |
| SCHEMBL8444683 | 0.86 | KCNH2 (0.43) | KCNH2HTTMEN1KMT2ANR1I2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1487955-B1 | AMMONIUM NITRILES AND THE USE THEREOF AS HYDROPHOBIC BLEACHING ACTIVATORS | CLARIANT PRODUKTE DEUTSCHLAND (DE) | 2008-05-21 | — | — | EP | disclosed |
| US-7015185-B2 | Ammonium nitriles and the use thereof as hydrophobic bleaching activators | CLARIANT GMBH (DE) | 2006-03-21 | — | — | US | disclosed |
| US-20040266644-A1 | Ammonium nitriles and the use thereof as hydrophobic bleaching activators | CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) | 2004-12-30 | — | — | US | disclosed |
| EP-1487955-A1 | AMMONIUM NITRILES AND THE USE THEREOF AS HYDROPHOBIC BLEACHING ACTIVATORS | Clariant GmbH (DE) | 2004-12-22 | — | — | EP | disclosed |
| WO-2003078561-A1 | AMMONIUM NITRILES AND THE USE THEREOF AS HYDROPHOBIC BLEACHING ACTIVATORS | CLARIANT GMBH (DE) | 2003-09-25 | — | — | WO | disclosed |