Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Bicarbonate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK1E | P49674 | 1/20 | 0.54 |
| ▸ | MMP2 | P08253 | 17/20 | 0.47 |
| ▸ | MMP3 | P08254 | 12/20 | 0.47 |
| ▸ | MMP1 | P03956 | 10/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | MMP7 | P09237 | 6/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL4328260 | 0.96 | CSNK1E (0.52) | CSNK1EMMP2MMP3MMP1CNR2 | |
| SCHEMBL8386222 | 0.94 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1MMP7 | |
| SCHEMBL8387575 | 0.94 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1MMP7 | |
| SCHEMBL2392222 | 0.94 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1MMP7 | |
| SCHEMBL25287896 | 0.94 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1MMP7 | |
| SCHEMBL25283495 | 0.94 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1MMP7 | |
| SCHEMBL8382112 | 0.94 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1MMP7 | |
| SCHEMBL8386102 | 0.94 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1MMP7 | |
| SCHEMBL8381675 | 0.94 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1MMP7 | |
| SCHEMBL8382904 | 0.94 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1MMP7 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5137923-A | Lipophilic quaternary ammonium salicylates, their use in cosmetics and in dermopharmacy | L'OREAL (FR) | 1992-08-11 | — | — | US | disclosed |
| US-5019567-A | Benzoyl peroxide--quaternary ammonium lipophilic salicylate based pharmaceutical and cosmetic compositions and their use especially in treatment of acne | L'OREAL (FR) | 1991-05-28 | — | — | US | disclosed |
| US-5001156-A | Lipophilic quaternary ammonium salicylates, their use in cosmetics and in dermopharmacy | L'OREAL (FR) | 1991-03-19 | — | — | US | disclosed |
| US-4857525-A | Quaternary ammonium retinoates, their use in cosmetics and in dermopharmacy | L'OREAL (FR) | 1989-08-15 | — | — | US | disclosed |