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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | DAO | P14920 | 1/20 | 0.64 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.64 |
| ▸ | CES1 | P23141 | 5/20 | 0.54 |
| ▸ | CES2 | O00748 | 4/20 | 0.54 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
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 SCHEMBL5918273 | 1.00 | TSHR (0.64) | TSHRDAONAPRTCES1CES2 | |
| Benzoic Acid SCHEMBL770049 | 1.00 | TSHR (0.64) | TSHRDAONAPRTCES1CES2 | |
| Terephthalic Acid SCHEMBL11564620 | 0.91 | TSHR (0.60) | TSHRDAONAPRTSRD5A2ALDH1A1 | |
| Terephthalic Acid SCHEMBL2160594 | 0.91 | TSHR (0.60) | TSHRDAONAPRTSRD5A2ALDH1A1 | |
| Benzoic Acid SCHEMBL17594839 | 0.89 | TSHR (0.61) | TSHRDAONAPRTCES1CES2 | |
| Isophthalic Acid SCHEMBL9989646 | 0.87 | CA12 (0.52) | TSHRDAONAPRTALDH1A1TP53 | |
| Benzoic Acid SCHEMBL28693411 | 0.85 | TSHR (0.78) | TSHRDAONAPRTCES1CES2 | |
| Benzoic Acid SCHEMBL2400344 | 0.85 | TSHR (0.78) | TSHRDAONAPRTCES1CES2 | |
| Benzoic Acid SCHEMBL28601772 | 0.85 | TSHR (0.78) | TSHRDAONAPRTCES1CES2 | |
| Benzoic Acid SCHEMBL9705228 | 0.85 | TSHR (0.78) | TSHRDAONAPRTCES1CES2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106633797-A | Novel environment-friendly high-polymer material | 无锡市四方达高分子材料有限公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-104761993-A | Polyurethane anticorrosive thermal-insulation paint and preparation method thereof | GUANGXI JISHUN ENERGY TECHNOLOGY CO LTD | 2015-07-08 | — | — | CN | disclosed |
| US-7776968-B2 | Thermoplastic elastomer composition and thermoplastic resin composition using the same | RIKEN TECHNOS CORP. (JP) | 2010-08-17 | — | — | US | disclosed |
| EP-1566405-B1 | Thermoplastic elastomer composition | RIKEN TECHNOS CORP (JP) | 2007-07-18 | — | — | EP | disclosed |
| US-20050187355-A1 | Thermoplastic elastomer composition and thermoplastic resin composition using the same | RIKEN TECHNOS CORP. (JP) | 2005-08-25 | — | — | US | disclosed |
| EP-1566405-A1 | Thermoplastic elastomer composition | Riken Technos Corporation (JP) | 2005-08-24 | — | — | EP | disclosed |
| US-6855075-B2 | Golf ball cover composition and golf ball | BRIDGESTONE SPORTS CO., LTD. (JP) | 2005-02-15 | — | — | US | disclosed |
| US-20030073517-A1 | Golf ball cover composition and golf ball | BRIDGESTONE SPORTS CO., LTD. | 2003-04-17 | — | — | US | disclosed |