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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.31 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 SCHEMBL95011 | 0.96 | TSHR (0.42) | TSHRTP53HCAR2CA1CA2 | |
| Bicarbonate SCHEMBL700909 | 0.96 | TSHR (0.42) | TSHRTP53HCAR2CA1CA2 | |
| Benzene SCHEMBL28129217 | 0.90 | TSHR (0.38) | TSHRTP53HCAR2CA1CA2 | |
| Methyl Alcohol SCHEMBL28400157 | 0.84 | — | — | |
| Bicarbonate SCHEMBL4239205 | 0.84 | TSHR (0.35) | TSHRTP53HCAR2 | |
| Tert-Butyl Hydroperoxide SCHEMBL28766180 | 0.82 | ALDH1A1 (0.50) | TSHRTP53HCAR2ALDH1A1 | |
| SCHEMBL126090 | 0.80 | — | — | |
| Bicarbonate SCHEMBL736567 | 0.78 | ALDH1A1 (0.32) | TSHRFFAR3ALDH1A1 | |
| SCHEMBL29728818 | 0.77 | TSHR (0.37) | TSHRALDH1A1 | |
| Benzene SCHEMBL864531 | 0.77 | TSHR (0.32) | TSHRALDH1A1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7270938-B2 | Photopolymerizable composition, light sensitive planographic printing plate material and manufacturing method of planographic printing plate | KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) | 2007-09-18 | — | — | US | disclosed |
| US-20060147840-A1 | Photopolymerizable composition, light sensitive planographic printing plate material and manufacturing method of planographic printing plate | KONICA MINOLATA MEDICAL & GRAPHIC, INC. | 2006-07-06 | — | — | US | disclosed |
| EP-0821276-B1 | Light sensitive composition and method for manufacturing planographic printing plate employing the same | KONISHIROKU PHOTO IND (JP) | 2002-05-02 | — | — | EP | disclosed |
| EP-0795787-B1 | Photopolymerizable composition and presensitized planographic printing plate employing the same | KONISHIROKU PHOTO IND (JP) | 2001-02-07 | — | — | EP | disclosed |
| US-5965324-A | CONSISTS OF PYRAZOLOAZOLE METHINE OR DIMETHINE DYES WITH RADICAL GENERATING AGENT | KONICA CORPORATION (JP) | 1999-10-12 | — | — | US | disclosed |
| US-5858617-A | COMPOSITION COMPRISING UNSATURATED COMPOUND AND PYRAZOLOAZOLE METHINE OR DIMETHINE DYE PHOTOINITIATOR; NON-STAINING, SENSITIVITY, STORAGE STABILITY | KONICA CORPORATION (JP) | 1999-01-12 | — | — | US | disclosed |
| EP-0821276-A1 | Light sensitive composition and method for manufacturing planographic printing plate employing the same | KONICA CORPORATION (JP) | 1998-01-28 | — | — | EP | disclosed |
| EP-0795787-A1 | Photopolymerizable composition and presensitized planographic printing plate employing the same | KONICA CORPORATION (JP) | 1997-09-17 | — | — | EP | disclosed |