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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.35 |
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 SCHEMBL6631993 | 0.92 | CA1 (0.44) | CA2CA1TSHRCYP3A4NFKB1 | |
| Propionic Acid SCHEMBL7874567 | 0.89 | CA2 (0.40) | CA2CA1TSHRCYP3A4NFKB1 | |
| Iodide SCHEMBL31682997 | 0.77 | TSHR (0.38) | TSHR | |
| Bromide SCHEMBL31683217 | 0.77 | TSHR (0.38) | TSHR | |
| SCHEMBL7874589 | 0.77 | TSHR (0.38) | TSHR | |
| Fluoride Ion SCHEMBL7871209 | 0.77 | TSHR (0.38) | TSHR | |
| Water SCHEMBL4825879 | 0.77 | TSHR (0.38) | TSHR | |
| Bicarbonate SCHEMBL28572079 | 0.77 | CA2 (0.38) | CA2CA1TSHRCYP3A4NFKB1 | |
| Bicarbonate SCHEMBL9619186 | 0.75 | CA2 (0.41) | CA2CA1TSHRCYP3A4NFKB1 | |
| Benzoic Acid SCHEMBL31683061 | 0.75 | CA2 (0.57) | CA2TSHRNPSR1 |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6316575-B1 | MELT TRANSESTERIFICATION OF DIOL COMPOUND AND CARBOANTE COMPOUND USING CATALYST COMPRISING A PHOSPHORUS-CONTAINING BASIC COMPOUND QUATERNARY PHOSPHONIUM SALT TO FORM POLYCARBONATE | IDEMITSU KOSAN CO., LTD. (JP) | 2001-11-13 | — | — | US | claimed |
| US-7629431-B2 | Polycarbonate prepolymer for solid phase polymerization and process for producing polycarbonate | IDEMITSU KOSAN CO., LTD. (JP) | 2009-12-08 | — | — | US | disclosed |
| US-20080064847-A1 | Oxidative carbonylation; molecular weight control | IDEMISU KOSAN CO., LTD. (JP) | 2008-03-13 | — | — | US | disclosed |
| EP-0807657-B1 | PROCESS FOR PRODUCING POLYCARBONATE | IDEMITSU KOSAN CO (JP) | 2004-05-19 | — | — | EP | disclosed |
| US-6476249-B1 | Copolycarbonate and process for producing the same | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2002-11-05 | — | — | US | disclosed |
| US-6462165-B1 | REDUCED CONTENT OF IMPURITIES SUCH AS REMAINING MONOMERS AND OLIGOMERS AND HAVING EXCELLENT PHYSICAL PROPERTIES SUCH AS IMPACT STRENGTH, AND ALSO TO OPTICAL MATERIALS AND BLOW MOLDING MATERIALS | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2002-10-08 | — | — | US | disclosed |
| US-6399738-B1 | OXIDATIVE CARBONYLATION OF AROMATIC HYDROXY COMPOUND WITH CARBON MONOXIDE AND OXYGEN | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2002-06-04 | — | — | US | disclosed |
| US-6316575-B1 | MELT TRANSESTERIFICATION OF DIOL COMPOUND AND CARBOANTE COMPOUND USING CATALYST COMPRISING A PHOSPHORUS-CONTAINING BASIC COMPOUND QUATERNARY PHOSPHONIUM SALT TO FORM POLYCARBONATE | IDEMITSU KOSAN CO., LTD. (JP) | 2001-11-13 | — | — | US | disclosed |
| US-6258922-B1 | TRANSESTERIFICATION A DICARBONATE AND DIHYDROXY COMPOUND | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2001-07-10 | — | — | US | disclosed |
| US-6245878-B1 | POLYMERIZING POLYCARBONATE PREPOLYMER IN SOLID PHASE IN PRESENCE OF PHOSPHORUS-CONTAINING BASIC COMPOUND AS CATALYST IN ATMOSPHERE OF POOR SOLVENT GAS SELECTED FROM LINEAR ALIPHATIC HYDROCARBONS AND CYCLOALIPHATIC HYDROCARBONS | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2001-06-12 | — | — | US | disclosed |
| EP-1069146-A1 | POLYCARBONATE AND OPTICAL MATERIAL | Idemitsu Petrochemical Co., Ltd. (JP) | 2001-01-17 | — | — | EP | disclosed |
| EP-1048684-A1 | PROCESS FOR PRODUCING POLYCARBONATE AND OPTICAL-DISK SUBSTRATE | Idemitsu Petrochemical Co., Ltd. (JP) | 2000-11-02 | — | — | EP | disclosed |
| EP-1035150-A1 | COPOLYCARBONATE AND PROCESS FOR PRODUCING THE SAME | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2000-09-13 | — | — | EP | disclosed |
| EP-1033381-A1 | PROCESS FOR PRODUCING POLYCARBONATE | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2000-09-06 | — | — | EP | disclosed |
| US-5922826-A | TRANSESTERIFICATION IN PRESENCE OF A POLYMERIZATION CATALYST CONTAINING AN ORGANONITROGEN COMPOUND AND A QUATERNARY PHOSPHONIUM SALT TO PRODUCE POLYCARBONATE | IDEMITSU KOSAN CO., LTD. (JP) | 1999-07-13 | — | — | US | disclosed |
| EP-0908484-A1 | PROCESSES FOR THE PRODUCTION OF POLYCARBONATE | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1999-04-14 | — | — | EP | disclosed |
| EP-0807657-A1 | PROCESS FOR PRODUCING POLYCARBONATE | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1997-11-19 | — | — | EP | disclosed |