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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | PGD | P52209 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.31 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.31 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.31 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.31 |
| ▸ | GGT1 | P19440 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 SCHEMBL28516525 | 0.79 | TSHR (0.39) | TSHRALDH1A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL5167196 | 0.78 | TSHR (0.42) | TSHRPGDALDH1A1SLC1A3SLC1A2 | |
| SCHEMBL5051493 | 0.76 | TSHR (0.46) | TSHRALDH1A1CA2MAPK1CA1 | |
| SCHEMBL587731 | 0.76 | TSHR (0.46) | TSHRALDH1A1CA2MAPK1CA1 | |
| SCHEMBL11487638 | 0.73 | TSHR (0.48) | TSHRPGDALDH1A1HMGCRCHRM1 | |
| SCHEMBL7532147 | 0.73 | TSHR (0.42) | TSHRALDH1A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL446452 | 0.73 | TSHR (0.48) | TSHRPGDALDH1A1HMGCRCHRM1 | |
| SCHEMBL1609485 | 0.71 | — | — | |
| SCHEMBL17123002 | 0.71 | — | — | |
| SCHEMBL4271862 | 0.71 | TSHR (0.58) | TSHRMEN1KMT2A |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109422910-B | Blowing agents comprising orthoformate and carbonate alkanolamine salts and use in polyurethane continuous panel foam materials | 补天新材料技术有限公司 | 2021-04-13 | — | — | CN | claimed |
| CN-109422907-B | Blowing agents comprising polyamines and alkanolamine salts and use in polyurethane continuous panel foam materials | 补天新材料技术有限公司 | 2021-04-13 | — | — | CN | claimed |
| CN-109422904-B | Blowing agents comprising secondary amines and alkanolamine salts and use in polyurethane continuous panel foam materials | 山东理工大学 | 2021-03-19 | — | — | CN | claimed |
| CN-109422899-B | Blowing agents comprising tertiary amines and alkanolamine salts and use in polyurethane continuous panel foam materials | 山东理工大学 | 2021-03-19 | — | — | CN | claimed |
| CN-109422902-B | Foaming agent comprising an alkanolamine salt and use in polyurethane continuous panel foam materials | 山东理工大学 | 2021-02-12 | — | — | CN | claimed |
| CN-109422907-B | Blowing agents comprising polyamines and alkanolamine salts and use in polyurethane continuous panel foam materials | 补天新材料技术有限公司 | 2021-04-13 | — | — | CN | disclosed |
| CN-109422910-B | Blowing agents comprising orthoformate and carbonate alkanolamine salts and use in polyurethane continuous panel foam materials | 补天新材料技术有限公司 | 2021-04-13 | — | — | CN | disclosed |
| CN-109422910-B | Blowing agents comprising orthoformate and carbonate alkanolamine salts and use in polyurethane continuous panel foam materials | 补天新材料技术有限公司 | 2021-04-13 | — | — | CN | disclosed |
| CN-109422907-B | Blowing agents comprising polyamines and alkanolamine salts and use in polyurethane continuous panel foam materials | 补天新材料技术有限公司 | 2021-04-13 | — | — | CN | disclosed |
| CN-109422904-B | Blowing agents comprising secondary amines and alkanolamine salts and use in polyurethane continuous panel foam materials | 山东理工大学 | 2021-03-19 | — | — | CN | disclosed |
| CN-109422904-B | Blowing agents comprising secondary amines and alkanolamine salts and use in polyurethane continuous panel foam materials | 山东理工大学 | 2021-03-19 | — | — | CN | disclosed |
| CN-109422899-B | Blowing agents comprising tertiary amines and alkanolamine salts and use in polyurethane continuous panel foam materials | 山东理工大学 | 2021-03-19 | — | — | CN | disclosed |
| CN-109422899-B | Blowing agents comprising tertiary amines and alkanolamine salts and use in polyurethane continuous panel foam materials | 山东理工大学 | 2021-03-19 | — | — | CN | disclosed |
| CN-109422902-B | Foaming agent comprising an alkanolamine salt and use in polyurethane continuous panel foam materials | 山东理工大学 | 2021-02-12 | — | — | CN | disclosed |
| CN-109422902-B | Foaming agent comprising an alkanolamine salt and use in polyurethane continuous panel foam materials | 山东理工大学 | 2021-02-12 | — | — | CN | disclosed |