Known targets — ChEMBL curated mechanism
ACVR1ADORA1ADORA2AADORA2BADORA3ESR1ESR2FLT3GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSC1GSK3AGSK3BHRH1HRH2HTR7IDH1IDH2IMPA1IRAK1JAK1JAK2JAK3MEN1OPRM1P2RX3PDE5ASCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASIGMAR1SLC6A2SYKTACR1TOP2ATYK2
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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | APEX1 | P27695 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | HMGCR | P04035 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
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 SCHEMBL379527 | 0.98 | TSHR (0.56) | TSHRALDH1A1LMNAAPEX1CA4 | |
| Citric Acid SCHEMBL18584347 | 0.96 | TSHR (0.54) | TSHRALDH1A1LMNAAPEX1CA4 | |
| Citric Acid SCHEMBL7083476 | 0.88 | CA4 (0.50) | TSHRALDH1A1LMNAAPEX1CA4 | |
| Citric Acid SCHEMBL36782 | 0.86 | CA4 (0.52) | TSHRALDH1A1LMNAAPEX1CA4 | |
| Citric Acid SCHEMBL22229905 | 0.82 | ALDH1A1 (0.65) | TSHRALDH1A1LMNAAPEX1HMGCR | |
| Citric Acid SCHEMBL3683509 | 0.81 | ALDH1A1 (0.54) | TSHRALDH1A1LMNAAPEX1CA4 | |
| Citric Acid SCHEMBL23320255 | 0.81 | CA4 (0.56) | TSHRALDH1A1CA4HMGCRCHRM1 | |
| Citric Acid SCHEMBL1092138 | 0.81 | CA4 (0.64) | TSHRALDH1A1CA4HMGCRCHRM1 | |
| Citric Acid SCHEMBL28287041 | 0.81 | CA4 (0.64) | TSHRALDH1A1CA4HMGCRCHRM1 | |
| Citric Acid SCHEMBL28164924 | 0.81 | CA4 (0.64) | TSHRALDH1A1CA4HMGCRCHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4703045-A | BETAINE SALTS | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (FR) | 1987-10-27 | — | — | US | disclosed |
| US-4593020-A | Betaine citrate | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (FR) | 1986-06-03 | — | — | US | disclosed |