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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CPT2 | P23786 | 1/20 | 0.32 |
| ▸ | ACLY | P53396 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.31 |
| ▸ | LMNA | P02545 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SLC13A5 | Q86YT5 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL27526894 | 0.84 | GAA (0.38) | GAA | |
| SCHEMBL6896468 | 0.83 | GAA (0.40) | GAA | |
| SCHEMBL180892 | 0.83 | GAA (0.40) | GAA | |
| Glycerin SCHEMBL28270843 | 0.82 | GAA (0.36) | ALDH1A1LMNAGAA | |
| Methane SCHEMBL27944275 | 0.82 | GAA (0.39) | GAA | |
| Citric Acid SCHEMBL27815459 | 0.75 | ALDH1A1 (0.62) | ALDH1A1CPT2ACLYKDM4ELMNA | |
| Citric Acid SCHEMBL28077148 | 0.75 | ALDH1A1 (0.62) | ALDH1A1CPT2ACLYKDM4ELMNA | |
| SCHEMBL4942263 | 0.74 | GAA (0.35) | GAA | |
| Citric Acid SCHEMBL27697400 | 0.73 | ALDH1A1 (0.50) | ALDH1A1CPT2ACLYKDM4ELMNA | |
| Citric Acid SCHEMBL428394 | 0.73 | ALDH1A1 (0.65) | ALDH1A1CPT2ACLYKDM4ELMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102143751-A | Use of rifalazil to treat colonic disorders | ACTIVBIOTICS PHARMA LLC | 2011-08-03 | — | — | CN | disclosed |