Known targets — ChEMBL curated mechanism
ACVR1ADORA1ADORA2AADORA2BADORA3ESR1ESR2FLT3GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSC1HRH1HTR7IDH1IDH2IRAK1JAK1JAK2JAK3MEN1OPRM1P2RX3PDE5ASCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASIGMAR1SLC6A2SYKTACR1TOP2ATYK2
The experimentally established mechanism targets of Citric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 4/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.55 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.46 |
| ▸ | CHRNG | P07510 | 2/20 | 0.46 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.46 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.46 |
| ▸ | CHRND | Q07001 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13227345 | 0.86 | SLC6A3 (0.61) | SLC6A3SLC6A4SLC6A2CHRNA1CHRNG | |
| SCHEMBL4433623 | 0.86 | SLC6A3 (0.61) | SLC6A3SLC6A4SLC6A2CHRNA1CHRNG | |
| SCHEMBL12313096 | 0.86 | SLC6A3 (0.61) | SLC6A3SLC6A4SLC6A2CHRNA1CHRNG | |
| SCHEMBL2640060 | 0.86 | SLC6A3 (0.61) | SLC6A3SLC6A4SLC6A2CHRNA1CHRNG | |
| SCHEMBL3587139 | 0.86 | SLC6A3 (0.61) | SLC6A3SLC6A4SLC6A2CHRNA1CHRNG | |
| Cadaverine Tartrate SCHEMBL3553053 | 0.85 | SLC6A3 (0.59) | SLC6A3SLC6A4SLC6A2CHRNA1CHRNG | |
| Cadaverine Tartrate SCHEMBL2639730 | 0.85 | SLC6A3 (0.59) | SLC6A3SLC6A4SLC6A2CHRNA1CHRNG | |
| Cadaverine Tartrate SCHEMBL6013535 | 0.85 | SLC6A3 (0.59) | SLC6A3SLC6A4SLC6A2CHRNA1CHRNG | |
| Cadaverine Tartrate SCHEMBL2639906 | 0.84 | SLC6A3 (0.58) | SLC6A3SLC6A4SLC6A2CHRNA1CHRNG | |
| SCHEMBL13255979 | 0.78 | SLC6A3 (0.62) | SLC6A3SLC6A4SLC6A2CHRNA1CHRNG |
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 |
|---|---|---|---|---|---|---|---|
| US-7700619-B2 | 2-methoxymethyl-3-(3,4-dichlorophenyl)-8-azabicyclo[3.2.1]octane tartrate salts | NEUROSEARCH A/S (DK) | 2010-04-20 | — | — | US | disclosed |
| EP-1651223-B1 | 2-METHOXYMETHYL-3-(3,4-DICHLOROPHENYL)-8-AZABICYCLO[3.2.1]OCTANE TARTRATE SALTS | NEUROSEARCH AS (DK) | 2007-02-28 | — | — | EP | disclosed |
| US-20070043075-A1 | 2-Methoxymethyl-3-(3,4-dichlorophenyl)-8-azabicyclo[3.2.1]octane tartrate salts | SANIONA A/S (DK) | 2007-02-22 | — | — | US | disclosed |
| EP-1651223-A1 | 2-METHOXYMETHYL-3-(3,4-DICHLOROPHENYL)-8-AZABICYCLO[3.2.1]OCTANE TARTRATE SALTS | NEUROSEARCH A/S (DK) | 2006-05-03 | — | — | EP | disclosed |
| WO-2005011694-A1 | 2-METHOXYMETHYL-3-(3,4-DICHLOROPHENYL)-8-AZABICYCLO[3.2.1]OCTANE TARTRATE SALTS | NEUROSEARCH A/S (DK) | 2005-02-10 | — | — | WO | disclosed |