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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | DAO | P14920 | 1/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
| ▸ | CES2 | O00748 | 3/20 | 0.47 |
| ▸ | CES1 | P23141 | 3/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 3/20 | 0.46 |
| ▸ | HRH1 | P35367 | 3/20 | 0.46 |
| ▸ | RARB | P10826 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CASR | P41180 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11590781 | 0.89 | RARB (0.51) | TSHRRARBALDH1A1 | |
| SCHEMBL14288441 | 0.88 | TP53 (0.51) | TSHRSIGMAR1RARBALDH1A1 | |
| SCHEMBL1293020 | 0.84 | SIGMAR1 (0.61) | POLBSIGMAR1HTR2AHRH1ALDH1A1 | |
| Benzoic Acid SCHEMBL29233380 | 0.84 | TSHR (0.52) | TSHRDAONAPRTCES2CES1 | |
| SCHEMBL959756 | 0.84 | RARB (0.53) | TSHRRARBALDH1A1 | |
| Benzoic Acid SCHEMBL2463701 | 0.84 | TSHR (0.52) | TSHRDAONAPRTCES2CES1 | |
| SCHEMBL6890371 | 0.83 | GRM2 (0.47) | TSHRPOLBRARBALDH1A1 | |
| Benzoic Acid SCHEMBL28845500 | 0.82 | TSHR (0.67) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL6573567 | 0.82 | TSHR (0.67) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL9157936 | 0.82 | TSHR (0.67) | TSHRDAONAPRTCES2CES1 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11737345-B2 | Organic electronic material, ink composition containing same, and organic thin film, organic electronic element, organic electroluminescent element, lighting device, and display device formed therewith | RESONAC CORPORATION (JP) | 2023-08-22 | — | — | US | disclosed |
| EP-2439804-B1 | ORGANIC ELECTRONIC MATERIAL, INK COMPOSITION CONTAINING SAME, AND ORGANIC THIN FILM, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, LIGHTING DEVICE, AND DISPLAY DEVICE FORMED THEREWITH | SHOWA DENKO MATERIALS CO LTD (JP) | 2021-07-21 | — | — | EP | disclosed |
| US-20210028366-A1 | ORGANIC ELECTRONIC MATERIAL, INK COMPOSITION CONTAINING SAME, AND ORGANIC THIN FILM, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELETROLUMINESCENT ELEMENT, LIGHTING DEVICE, AND DISPLAY DEVICE FORMED THEREWITH | RESONAC CORPORATION (JP) | 2021-01-28 | — | — | US | disclosed |
| US-10840451-B2 | Organic electronic material, ink composition containing same, and organic thin film, organic electronic element, organic eletroluminescent element, lighting device, and display device formed therewith | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2020-11-17 | — | — | US | disclosed |
| CN-105514272-B | Hole injection layer and hole transmission layer | 日立化成株式会社 | 2018-09-14 | — | — | CN | disclosed |
| US-20180145257-A1 | ORGANIC ELECTRONIC MATERIAL, INK COMPOSITION CONTAINING SAME, AND ORGANIC THIN FILM, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELETROLUMINESCENT ELEMENT, LIGHTING DEVICE, AND DISPLAY DEVICE FORMED THEREWITH | RESONAC CORPORATION (JP) | 2018-05-24 | — | — | US | disclosed |
| US-9929346-B2 | Organic electronic material, ink composition containing same, and organic thin film, organic electronic element, organic electroluminescent element, lighting device, and display device formed therewith | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2018-03-27 | — | — | US | disclosed |
| US-9583714-B2 | Material for organic electronics, organic electronic element, organic electroluminescent element, display element using organic electroluminescent element, illuminating device, and display device | HITACHI CHEMICAL COMPANY, LTD. (JP) | 2017-02-28 | — | — | US | disclosed |
| CN-105514272-A | Hole injection layer and hole-transporting layer | HITACHI CHEMICAL CO LTD | 2016-04-20 | — | — | CN | disclosed |
| CN-102576812-B | Material for organic electronics, organic electronic element, organic electroluminescent element, and display element, lighting device, and display device using same | HITACHI CHEMICAL CO.,LTD. (JP) | 2016-03-16 | — | — | CN | disclosed |
| US-20150263288-A1 | ORGANIC ELECTRONIC MATERIAL, INK COMPOSITION CONTAINING SAME, AND ORGANIC THIN FILM, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELETROLUMINESCENT ELEMENT, LIGHTING DEVICE, AND DISPLAY DEVICE FORMED THEREWITH | RESONAC CORPORATION (JP) | 2015-09-17 | — | — | US | disclosed |
| EP-2485290-A1 | MATERIAL FOR ORGANIC ELECTRONICS, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY ELEMENT USING ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATING DEVICE, AND DISPLAY DEVICE | Hitachi Chemical Company, Ltd. (JP) | 2012-08-08 | — | — | EP | disclosed |
| US-20120181530-A1 | MATERIAL FOR ORGANIC ELECTRONICS, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY ELEMENT USING ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATING DEVICE, AND DISPLAY DEVICE | RESONAC CORPORATION (JP) | 2012-07-19 | — | — | US | disclosed |
| CN-102576812-A | Material for organic electronics, organic electronic element, organic electroluminescent element, and display element, lighting device, and display device using same | HITACHI CHEMICAL CO LTD | 2012-07-11 | — | — | CN | disclosed |
| US-20120074360-A1 | Organic Electronic Material, Ink Composition Containing Same, and Organic Thin Film, Organic Electronic Element, Organic Electroluminescent Element, Lighting Device, and Display Device Formed Therewith | HITACHI CHEMICAL COMPANY (JP) | 2012-03-29 | — | — | US | disclosed |