Known targets — ChEMBL curated mechanism
CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D
The experimentally established mechanism targets of Benzoic 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 | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 3/20 | 0.40 |
| ▸ | CES1 | P23141 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Benzoic Acid SCHEMBL3031636 | 1.00 | CA2 (0.41) | CA2CA4KDM4EALDH1A1HPGD | |
| Benzoic Acid SCHEMBL3848711 | 0.96 | KDM4E (0.39) | CA2CA4KDM4EALDH1A1HPGD | |
| Benzoic Acid SCHEMBL28939236 | 0.95 | HSP90AA1 (0.44) | KDM4EALDH1A1CES2CES1HTT | |
| Benzoic Acid SCHEMBL28733567 | 0.95 | HSP90AA1 (0.44) | KDM4EALDH1A1CES2CES1HTT | |
| Benzoic Acid SCHEMBL28733525 | 0.95 | HSP90AA1 (0.44) | KDM4EALDH1A1CES2CES1HTT | |
| Benzoic Acid SCHEMBL28733507 | 0.95 | HSP90AA1 (0.44) | KDM4EALDH1A1CES2CES1HTT | |
| Benzoic Acid SCHEMBL28733695 | 0.95 | HSP90AA1 (0.44) | KDM4EALDH1A1CES2CES1HTT | |
| Benzoic Acid SCHEMBL28733480 | 0.95 | HSP90AA1 (0.44) | KDM4EALDH1A1CES2CES1HTT | |
| Benzoic Acid SCHEMBL2523034 | 0.86 | CA2 (0.46) | CA2CA4ALDH1A1CES2CES1 | |
| SCHEMBL28733524 | 0.86 | CA1 (0.35) | CA2SMN1; SMN2PABPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20090281303-A1 | PROCESS FOR SILYLATING CELLULOSE | BASF SE (DE) | 2009-11-12 | — | — | US | disclosed |