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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.68 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 3/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | THRB | P10828 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.38 |
| ▸ | APP | P05067 | 2/20 | 0.34 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL28304846 | 0.98 | TSHR (0.71) | TSHRALDH1A1CYP3A4HPGDTP53 | |
| SCHEMBL2851828 | 0.96 | TSHR (0.74) | TSHRALDH1A1CYP3A4HPGDTP53 | |
| SCHEMBL26117 | 0.96 | — | — | |
| Acrylic Acid SCHEMBL28840693 | 0.94 | TSHR (0.65) | TSHRALDH1A1CYP3A4HPGDTP53 | |
| Acrylic Acid SCHEMBL2973647 | 0.94 | TSHR (0.65) | TSHRALDH1A1CYP3A4HPGDTP53 | |
| Phosphine SCHEMBL31268105 | 0.93 | TSHR (0.71) | TSHRALDH1A1CYP3A4HPGDTP53 | |
| SCHEMBL28524911 | 0.93 | TSHR (0.71) | TSHRALDH1A1CYP3A4HPGDTP53 | |
| SCHEMBL31339001 | 0.93 | TSHR (0.71) | TSHRALDH1A1CYP3A4HPGDTP53 | |
| Hydroxyl Radical SCHEMBL28140965 | 0.93 | TSHR (0.71) | TSHRALDH1A1CYP3A4HPGDTP53 | |
| Ammonia Solution, Strong SCHEMBL28302963 | 0.93 | TSHR (0.71) | TSHRALDH1A1CYP3A4HPGDTP53 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101023108-A | Carbamate functional addition polymers and a method for their preparation | BASF CORP (US) | 2007-08-22 | — | — | CN | disclosed |
| CN-1151208-C | Impact abrasion resistant coating compositions, method therefore and coated article | 巴斯福公司 | 2004-05-26 | — | — | CN | disclosed |
| CN-1088464-C | Coating composite for improving physical characteristic of solidified coating treated by steam | PPG IND OHIO INC (US) | 2002-07-31 | — | — | CN | disclosed |
| CN-1197823-A | Impact abrasion resistant coating compositions, method therefore and coated article | BASF CORP (US) | 1998-11-04 | — | — | CN | disclosed |
| CN-1185469-A | Coating composite for improving physical characteristic of solidified coating treated by steam | BASF AG (US) | 1998-06-24 | — | — | CN | disclosed |