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 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 2/20 | 0.33 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
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 SCHEMBL4835906 | 0.91 | TSHR (0.44) | TSHRDAONAPRTCYP1A2CYP2D6 | |
| Benzoic Acid SCHEMBL4834699 | 0.86 | TSHR (0.48) | TSHRDAONAPRTCYP1A2CYP2D6 | |
| Benzoic Acid SCHEMBL1786799 | 0.80 | DAO (0.41) | TSHRDAONAPRTCYP1A2CYP2D6 | |
| Benzoic Acid SCHEMBL1785700 | 0.79 | TSHR (0.47) | TSHRDAONAPRTCYP1A2CYP2D6 | |
| Benzoic Acid SCHEMBL1784952 | 0.76 | TSHR (0.44) | TSHRDAONAPRTCYP1A2CYP2D6 | |
| Benzoic Acid SCHEMBL1786034 | 0.76 | TSHR (0.44) | TSHRDAONAPRTCYP1A2CYP2D6 | |
| Benzoic Acid SCHEMBL1786375 | 0.76 | TSHR (0.50) | TSHRDAONAPRTCYP1A2CYP2D6 | |
| Benzoic Acid SCHEMBL1788707 | 0.75 | TSHR (0.45) | TSHRDAONAPRTCYP1A2CYP2D6 | |
| Benzoic Acid SCHEMBL1784037 | 0.73 | TSHR (0.50) | TSHRDAONAPRTCYP1A2CYP2D6 | |
| Benzoic Acid SCHEMBL1784088 | 0.73 | TSHR (0.50) | TSHRDAONAPRTMEN1KMT2A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3486263-A2 | SELF-LIMITING CATALYST COMPOSITION WITH NO SILANE | W.R. Grace & CO. - CONN. (US) | 2019-05-22 | — | — | EP | disclosed |
| EP-2185600-B1 | SELF-LIMITING CATALYST COMPOSITION WITH NO SILANE | GRACE W R & CO (US) | 2018-10-31 | — | — | EP | disclosed |
| US-9796796-B2 | Self-limiting catalyst composition with No silane | W. R. GRACE & CO.-CONN. (US) | 2017-10-24 | — | — | US | disclosed |
| US-20110124491-A1 | Self-Limiting Catalyst Composition with No Silane | W. R. GRACE & CO.-CONN. | 2011-05-26 | — | — | US | disclosed |
| EP-2185600-A1 | SELF-LIMITING CATALYST COMPOSITION WITH NO SILANE | Dow Global Technologies Inc. (US) | 2010-05-19 | — | — | EP | disclosed |
| WO-2009029447-A1 | SELF-LIMITING CATALYST COMPOSITION WITH NO SILANE | DOW GLOBAL TECHNOLOGIES INC. (US) | 2009-03-05 | — | — | WO | disclosed |