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 | 4/20 | 1.00 |
| ▸ | DAO | P14920 | 1/20 | 1.00 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 1.00 |
| ▸ | CES2 | O00748 | 3/20 | 0.78 |
| ▸ | CES1 | P23141 | 3/20 | 0.78 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.78 |
| ▸ | TP53 | P04637 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.65 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.59 |
| ▸ | CA12 | O43570 | 2/20 | 0.58 |
| ▸ | CA1 | P00915 | 2/20 | 0.58 |
| ▸ | CA2 | P00918 | 2/20 | 0.58 |
| ▸ | CA3 | P07451 | 2/20 | 0.58 |
| ▸ | CA4 | P22748 | 2/20 | 0.58 |
| ▸ | CA6 | P23280 | 2/20 | 0.58 |
| ▸ | CA5A | P35218 | 2/20 | 0.58 |
| ▸ | CA7 | P43166 | 2/20 | 0.58 |
| ▸ | CA9 | Q16790 | 2/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.58 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.58 |
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 SCHEMBL4591761 | 1.00 | TSHR (1.00) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL149318 | 1.00 | TSHR (1.00) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL9751726 | 1.00 | TSHR (1.00) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL407365 | 1.00 | TSHR (1.00) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL137419 | 1.00 | TSHR (1.00) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL11602198 | 1.00 | TSHR (1.00) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL3966600 | 1.00 | TSHR (1.00) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL976149 | 1.00 | TSHR (1.00) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL7719037 | 1.00 | TSHR (1.00) | TSHRDAONAPRTCES2CES1 | |
| Benzoic Acid SCHEMBL2458489 | 1.00 | TSHR (1.00) | 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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3614991-A1 | REDUCING THE TURBIDITY OF NAIL VARNISH | International Lacquers S.A. (LU) | 2020-03-04 | — | — | EP | claimed |
| EP-1124842-A1 | BETULINIC ACID AND DERIVATIVES THEREOF USEFUL FOR THE TREATMENT OF NEUROECTODERMAL TUMORS | Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) | 2001-08-22 | — | — | EP | claimed |
| WO-2000024762-A1 | BETULINIC ACID AND DERIVATIVES THEREOF USEFUL FOR THE TREATMENT OF NEUROECTODERMAL TUMORS | Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) | 2000-05-04 | — | — | WO | claimed |
| US-4618675-A | Derivatives and reduction products of D-glucopyranosyl-alpha(1→5)-d-arabinonic acid; and production of same | SUDDEUTSCHE ZUCKER-AKTIENGESELLSCHAFT (DE) | 1986-10-21 | — | — | US | claimed |
| EP-0114954-B1 | DERIVATIVES AND REDUCTION PRODUCTS OF D-GLUCOPYRANOSYL-ALPHA(1-5)-D-ARBONIC ACID, THEIR PREPARATION AND USE | Süddeutsche Zucker-Aktiengesellschaft (DE) | 1986-02-19 | — | — | EP | claimed |
| CN-116813925-A | Multi-branched aromatic tertiary amine supermolecule organic framework material and preparation method thereof | 佛山科学技术学院 | 2023-09-29 | — | — | CN | disclosed |
| CN-115667263-A | Pyrrolo [2,3-D ] pyrimidine derivatives | 辉瑞公司 | 2023-01-31 | — | — | CN | disclosed |
| CN-115484962-A | Use of nicotinamide mononucleotide or certain derivatives thereof for preventing and/or treating pain in the lower back and neck, and corresponding compositions | 努瓦米德股份有限公司 | 2022-12-16 | — | — | CN | disclosed |
| CN-114945368-A | N2-arylmethyl-4-haloalkyl-pyridazin-3-one compounds and uses thereof | 香槟-阿尔登兰斯大学 | 2022-08-26 | — | — | CN | disclosed |
| EP-3971163-A1 | METAL-ORGANIC STRUCTURAL BODY | Rikkyo Educational Corporation (JP) | 2022-03-23 | — | — | EP | disclosed |
| CN-113811525-A | Metal organic structure | 学校法人立教学院 | 2021-12-17 | — | — | CN | disclosed |
| CN-109836326-B | Cu metal-organic framework material based on benzophenanthrene carboxylic acid ligand, and preparation method and application thereof | 北京工业大学 | 2021-06-25 | — | — | CN | disclosed |
| WO-1996034609-A1 | MYELOGLYCAN | THE BIOMEMBRANE INSTITUTE (US) | 1996-11-07 | — | — | WO | disclosed |
| EP-0461745-A1 | Stabilization and foaming of polyvinylchloride resins | WITCO CORPORATION (US) | 1991-12-18 | — | — | EP | disclosed |
| US-5055495-A | Blowing agent and activator comprising a organotin mercapto acid ester and a diorgano tin oxide /ester complex; heat resistance | WITCO CORPORATION (US) | 1991-10-08 | — | — | US | disclosed |
| US-4977193-A | FOAMING IN PRESENCE OF ORGANOTIN MERCAPTO ACID ESTER | WITCO CORPORATION (US) | 1990-12-11 | — | — | US | disclosed |
| US-4618675-A | Derivatives and reduction products of D-glucopyranosyl-alpha(1→5)-d-arabinonic acid; and production of same | SUDDEUTSCHE ZUCKER-AKTIENGESELLSCHAFT (DE) | 1986-10-21 | — | — | US | disclosed |
| US-4247687-A | STEP-WISE PREPARATION OF 4'-DEOXY-NEOMYCIN B FROM PAROMOMYCIN | FARMITALIA CARLO ERBA S.P.A. (IT) | 1981-01-27 | — | — | US | disclosed |
| US-4156776-A | Sucrose derivatives | TATE & LYLE LTD. (GB) | 1979-05-29 | — | — | US | disclosed |
| US-4156776-A | Sucrose derivatives | TATE & LYLE LTD. (GB) | 1979-05-29 | — | — | US | disclosed |