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 | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.39 |
| ▸ | SLC13A5 | Q86YT5 | 9/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Benzotriazole SCHEMBL28282780 | 0.80 | CHRM1 (0.49) | ALDH1A1CYP1A2KDM4EKMT2ACHRM1 | |
| Benzotriazole SCHEMBL28282778 | 0.80 | CHRM1 (0.49) | ALDH1A1CYP1A2KDM4EKMT2ACHRM1 | |
| Citric Acid SCHEMBL7914867 | 0.80 | ACLY (0.44) | ALDH1A1 | |
| Benzotriazole SCHEMBL28276294 | 0.79 | L3MBTL1 (0.39) | ALDH1A1LMNAKDM4EKMT2ACHRM1 | |
| Benzotriazole SCHEMBL4948842 | 0.79 | L3MBTL1 (0.39) | ALDH1A1LMNAKDM4EKMT2ACHRM1 | |
| Benzotriazole SCHEMBL28276295 | 0.79 | L3MBTL1 (0.39) | ALDH1A1LMNAKDM4EKMT2ACHRM1 | |
| Benzotriazole SCHEMBL27815938 | 0.79 | CHRM1 (0.41) | ALDH1A1LMNACYP1A2KDM4EKMT2A | |
| Benzotriazole SCHEMBL27273686 | 0.79 | CHRM1 (0.41) | ALDH1A1LMNACYP1A2KDM4EKMT2A | |
| Benzotriazole SCHEMBL28212495 | 0.78 | NPC1 (0.38) | ALDH1A1KDM4EKMT2AMEN1CHRM1 | |
| Benzotriazole SCHEMBL21629494 | 0.76 | CHRM1 (0.37) | ALDH1A1LMNAKDM4EKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105638773-B | It is a kind of for polynary nanometer spray of operating room sterilization of instruments and preparation method thereof | 福建省诚佳建设工程管理有限公司 | 2018-06-08 | — | — | CN | claimed |
| CN-105638773-B | It is a kind of for polynary nanometer spray of operating room sterilization of instruments and preparation method thereof | 福建省诚佳建设工程管理有限公司 | 2018-06-08 | — | — | CN | disclosed |
| CN-105638773-B | It is a kind of for polynary nanometer spray of operating room sterilization of instruments and preparation method thereof | 福建省诚佳建设工程管理有限公司 | 2018-06-08 | — | — | CN | disclosed |
| CN-105638773-A | Multielement nanometer spray for operating room instrument sterilization and preparing method thereof | 吕欢 | 2016-06-08 | — | — | CN | disclosed |