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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | LOX | P28300 | 1/20 | 0.35 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL2169350 | 1.00 | TSHR (0.45) | TSHRMEN1KMT2AALDH1A1TDP1 | |
| Bicarbonate SCHEMBL11744374 | 0.97 | TSHR (0.43) | TSHRMEN1KMT2AALDH1A1TDP1 | |
| Bicarbonate SCHEMBL4954542 | 0.94 | TSHR (0.41) | TSHRMEN1KMT2AALDH1A1TDP1 | |
| Bicarbonate SCHEMBL11668335 | 0.93 | TSHR (0.45) | TSHRMEN1KMT2AALDH1A1TDP1 | |
| Oxalic Acid SCHEMBL11598461 | 0.88 | TSHR (0.41) | TSHRMEN1KMT2AALDH1A1TDP1 | |
| Bicarbonate SCHEMBL6155466 | 0.87 | TSHR (0.62) | TSHRMEN1KMT2AALDH1A1TDP1 | |
| Bicarbonate SCHEMBL11778367 | 0.87 | TSHR (0.46) | TSHRMEN1KMT2AALDH1A1TDP1 | |
| Bicarbonate SCHEMBL11573732 | 0.86 | ALDH1A1 (0.61) | TSHRMEN1KMT2AALDH1A1TDP1 | |
| Bicarbonate SCHEMBL6155323 | 0.84 | TSHR (0.59) | TSHRMEN1KMT2AALDH1A1TDP1 | |
| Heptanenitrile SCHEMBL6153881 | 0.84 | TSHR (0.59) | TSHRMEN1KMT2AALDH1A1TDP1 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0210637-B1 | OPTICAL COATING COMPOSITION | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-09-11 | — | — | EP | disclosed |
| US-4814257-A | PHOTOHARDENING ACRYLATE ESTER | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1989-03-21 | — | — | US | disclosed |
| EP-0224191-A2 | Method for forming optically smooth polymeric layers | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1987-06-03 | — | — | EP | disclosed |
| US-4650743-A | PHOTOPOLYMERIZED HYDROZYALKYL ACRYLATE AND OLIGOMER | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1987-03-17 | — | — | US | disclosed |
| EP-0210638-A2 | Optical coating composition | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1987-02-04 | — | — | EP | disclosed |
| EP-0210637-A2 | Optical coating composition | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1987-02-04 | — | — | EP | disclosed |
| US-4621113-A | Repeating block, oligomer-free, polyphase, thermoformable polyurethanes and method of preparation thereof | THE DOW CHEMICAL COMPANY (US) | 1986-11-04 | — | — | US | disclosed |
| US-4208495-A | Composition useful in making extensible films | PPG INDUSTRIES, INC. (US) | 1980-06-17 | — | — | US | disclosed |
| US-4208494-A | Composition useful in making extensible films | PPG INDUSTRIES, INC. (US) | 1980-06-17 | — | — | US | disclosed |
| US-4143091-A | COMPOSITION USEFUL IN MAKING EXTENSIBLE FILMS | PPG INDUSTRIES, INC. (US) | 1979-03-06 | — | — | US | disclosed |
| US-4115472-A | CONTAINING INSOLUBLE CROSSLINKED ACRYLIC POLYMER MICROPARTICLES | PPG INDUSTRIES, INC. (US) | 1978-09-19 | — | — | US | disclosed |
| US-4034017-A | REACTING POLYISOCYANATE, DIOL, HYDROXYALKYL ESTER OF UNSATURATED ACID, UNSATURATED MONOMER, CURING AGENT | PPG INDUSTRIES, INC. (US) | 1977-07-05 | — | — | US | disclosed |
| US-3975350-A | HYDROPHILIC OR HYDROGEL CARRIER SYSTEMS SUCH AS COATINGS, BODY IMPLANTS AND TOHER ARTICLES | PRINCETON POLYMER LABORATORIES, INCORPORATED (US) | 1976-08-17 | — | — | US | disclosed |