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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F7 | P08709 | 3/20 | 0.59 |
| ▸ | F3 | P13726 | 3/20 | 0.59 |
| ▸ | PPARG | P37231 | 6/20 | 0.54 |
| ▸ | PPARD | Q03181 | 5/20 | 0.54 |
| ▸ | PPARA | Q07869 | 5/20 | 0.54 |
| ▸ | TERT | O14746 | 3/20 | 0.54 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | BLM | P54132 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.54 |
| ▸ | FABP4 | P15090 | 3/20 | 0.54 |
| ▸ | TOP1 | P11387 | 3/20 | 0.54 |
| ▸ | USP2 | O75604 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.54 |
| ▸ | RECQL | P46063 | 2/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.54 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL4346776 | 0.93 | PPARG (0.63) | F7F3PPARGPPARDPPARA | |
| Acetic Acid SCHEMBL28235700 | 0.93 | F7 (0.57) | F7F3PPARGPPARDPPARA | |
| Bicarbonate SCHEMBL27573088 | 0.91 | TERT (0.67) | F7F3PPARGPPARDPPARA | |
| Propionic Acid SCHEMBL6860269 | 0.91 | F7 (0.61) | F7F3PPARGPPARDPPARA | |
| Bicarbonate SCHEMBL4351470 | 0.91 | TERT (0.67) | F7F3PPARGPPARDPPARA | |
| Bicarbonate SCHEMBL29059484 | 0.91 | TERT (0.67) | F7F3PPARGPPARDPPARA | |
| Carbamic Acid SCHEMBL19025897 | 0.91 | FAAH (0.55) | F7F3PPARGPPARDPPARA | |
| Bicarbonate SCHEMBL1007897 | 0.91 | TERT (0.67) | F7F3PPARGPPARDPPARA | |
| Acetone SCHEMBL18344256 | 0.90 | F7 (0.54) | F7F3PPARGPPARDPPARA | |
| Methyl Alcohol SCHEMBL20394593 | 0.87 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109054133-A | A kind of high-performing car Tire rubber material | 刘勇 | 2018-12-21 | — | — | CN | disclosed |
| CN-107759860-A | Rubber composition for tread of medium and large automobile tire | 湖南辰砾新材料有限公司 | 2018-03-06 | — | — | CN | disclosed |
| CN-107746487-A | High-wear-resistance rubber composition for automobile tire treads | 湖南辰砾新材料有限公司 | 2018-03-02 | — | — | CN | disclosed |
| WO-2017186633-A1 | AQUEOUS EMULSIONS OF CARBAMATO-FUNCTIONALIZED ORGANPOLYSILANES | WACKER CHEMIE AG (DE) | 2017-11-02 | — | — | WO | disclosed |
| WO-2017186638-A1 | COMPOSITIONS CONTAINING CARBAMATE FUNCTIONALIZED ORGANOPOLYSILOXANES AND CATIONIC SURFACTANTS | WACKER CHEMIE AG (DE) | 2017-11-02 | — | — | WO | disclosed |
| US-20090253044-A1 | Nonaqueous Electrolyte and Lithium ion Secondary Battery Using Same | MITSUI CHEMICALS, INC. (JP) | 2009-10-08 | — | — | US | disclosed |