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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 4/20 | 0.53 |
| ▸ | ESR1 known ✓ | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 known ✓ | Q92731 | 1/20 | 0.45 |
| ▸ | SCN1A known ✓ | P35498 | 4/20 | 0.44 |
| ▸ | SCN2A known ✓ | Q99250 | 4/20 | 0.44 |
| ▸ | SCN3A known ✓ | Q9NY46 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.58 |
| ▸ | LMNA | P02545 | 6/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| Citric Acid SCHEMBL3807378 | 0.88 | KDM4E (0.60) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL2469904 | 0.88 | LMNA (0.69) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| Aspirin Trelamine SCHEMBL2469193 | 0.83 | KDM4E (0.58) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| Aspirin Trelamine SCHEMBL30058246 | 0.83 | KDM4E (0.58) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL2468428 | 0.81 | LMNA (0.60) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| Citric Acid SCHEMBL11834776 | 0.76 | KDM4E (0.53) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| Zocainone SCHEMBL11841863 | 0.76 | KDM4E (0.50) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL383924 | 0.75 | ALDH1A1 (0.68) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL11338177 | 0.75 | ALDH1A1 (0.76) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 | |
| Citric Acid SCHEMBL28177656 | 0.74 | KDM4E (0.47) | KDM4ELMNAALDH1A1CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2370406-A1 | HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS | Yu, Chongxi (US) | 2011-10-05 | — | — | EP | disclosed |
| WO-2010065936-A1 | HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS | YU CHONGXI (US) | 2010-06-10 | — | — | WO | disclosed |