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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.47 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | RAD52 | P43351 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL9352881 | 0.89 | ACHE (0.44) | ACHEKDM4EPOLBALDH1A1HPGD | |
| SCHEMBL11073869 | 0.87 | ACHE (0.43) | ACHEKDM4EPOLBALDH1A1HPGD | |
| SCHEMBL29462670 | 0.87 | ACHE (0.43) | ACHEKDM4EPOLBALDH1A1HPGD | |
| Sulfuric Acid SCHEMBL9352888 | 0.86 | ACHE (0.42) | ACHEKDM4EPOLBRAB9AALDH1A1 | |
| Trifluoromethanesulfonic Acid SCHEMBL7077338 | 0.81 | GPR3 (0.41) | ACHEKDM4EALDH1A1HPGDGAA | |
| SCHEMBL11528687 | 0.81 | KDM4E (0.40) | ACHEKDM4EPOLBRAB9ARAD52 | |
| SCHEMBL11067593 | 0.81 | GAA (0.45) | ACHEKDM4EPOLBRAB9ARAD52 | |
| Trifluoromethanesulfonic Acid SCHEMBL31683143 | 0.81 | GPR3 (0.41) | ACHEKDM4EALDH1A1HPGDGAA | |
| SCHEMBL307903 | 0.81 | ACHE (0.53) | ACHE | |
| SCHEMBL29752612 | 0.81 | ACHE (0.53) | ACHE |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0531033-A1 | Corrosion inhibitor composition | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 1993-03-10 | — | — | EP | disclosed |
| US-5158693-A | Oligoquinolinium metal oxide salts as sulfur corrosion inhibitors | EXXON RESEARCH AND ENGINEERING CO. (US) | 1992-10-27 | — | — | US | disclosed |
| EP-0224779-A1 | Radical anion salts of 1,4,5,8-naphthalenetetracarboxylic acid derivatives, process for their preparation, and their use | BAYER AG (DE) | 1987-06-10 | — | — | EP | disclosed |
| US-4622400-A | SULFONATION, ALKALI FUSION | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) | 1986-11-11 | — | — | US | disclosed |