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 | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.35 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.35 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | PPP5C | P53041 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PPP2CA | P67775 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL65054 | 0.85 | — | — | |
| Bicarbonate SCHEMBL16668956 | 0.85 | CYP1A2 (0.58) | CYP1A2TDP1CA12CA2CA9 | |
| SCHEMBL7004904 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL9523475 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL1700097 | 0.82 | GNAI3 (0.42) | CYP1A2TDP1GNAI3GNAI1KDM4E | |
| Hydrochloric Acid SCHEMBL8080295 | 0.79 | GNAI3 (0.41) | CYP1A2TDP1GNAI3GNAI1KDM4E | |
| Carbamic Acid SCHEMBL29922252 | 0.79 | CYP1A2 (0.52) | CYP1A2TDP1CA12CA2CA9 | |
| SCHEMBL23742333 | 0.74 | GNAI3 (0.33) | CYP1A2TDP1CA2GNAI3GNAI1 | |
| SCHEMBL11378108 | 0.74 | — | — | |
| Bicarbonate SCHEMBL5993619 | 0.73 | ALDH1A1 (0.36) | CYP1A2CA2CA9GNAI3GNAI1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9956519-B2 | Absorbent for desulfurization of combustion gas and method of treating combustion gas using the same | HYUNDAI MOTOR COMPANY (KR) | 2018-05-01 | — | — | US | claimed |
| CN-104587798-A | ABSORBENT FOR DESULFURIZATION OF COMBUSTION GAS AND METHOD OF TREATING COMBUSTION GAS USING THE SAME | KIA MOTORS CORP | 2015-05-06 | — | — | CN | claimed |
| US-20150118136-A1 | ABSORBENT FOR DESULFURIZATION OF COMBUSTION GAS AND METHOD OF TREATING COMBUSTION GAS USING THE SAME | KOREA INSTITUTE OF ENERGY RESEARCH (KR) | 2015-04-30 | — | — | US | claimed |
| US-9956519-B2 | Absorbent for desulfurization of combustion gas and method of treating combustion gas using the same | HYUNDAI MOTOR COMPANY (KR) | 2018-05-01 | — | — | US | disclosed |
| CN-104587798-A | ABSORBENT FOR DESULFURIZATION OF COMBUSTION GAS AND METHOD OF TREATING COMBUSTION GAS USING THE SAME | KIA MOTORS CORP | 2015-05-06 | — | — | CN | disclosed |
| US-20150118136-A1 | ABSORBENT FOR DESULFURIZATION OF COMBUSTION GAS AND METHOD OF TREATING COMBUSTION GAS USING THE SAME | KOREA INSTITUTE OF ENERGY RESEARCH (KR) | 2015-04-30 | — | — | US | disclosed |