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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 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 | |
|---|---|---|---|---|
| SCHEMBL44413 | 0.97 | TSHR (0.42) | TSHRTDP1ALDH1A1HSD17B10DGAT1 | |
| SCHEMBL2311514 | 0.89 | ALDH1A1 (0.35) | TSHRTDP1ALDH1A1HSD17B10 | |
| Butane SCHEMBL28600788 | 0.89 | TSHR (0.35) | TSHRTDP1ALDH1A1HSD17B10 | |
| Bicarbonate SCHEMBL27668414 | 0.81 | TSHR (0.61) | TSHRTDP1ALDH1A1HSD17B10DGAT1 | |
| Bicarbonate SCHEMBL25265467 | 0.79 | — | — | |
| SCHEMBL44412 | 0.79 | TSHR (0.44) | TSHRTDP1ALDH1A1HSD17B10DGAT1 | |
| SCHEMBL4456119 | 0.78 | TSHR (0.39) | TSHRALDH1A1DGAT1 | |
| SCHEMBL19466229 | 0.77 | ALDH1A1 (0.30) | TSHRTDP1ALDH1A1HSD17B10 | |
| SCHEMBL29053766 | 0.76 | HPGD (0.32) | — | |
| SCHEMBL8438763 | 0.76 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020027222-A1 | POLYPROPYLENE-BASED ADHESIVE AND METHOD FOR PRODUCING SAME | 出光興産株式会社 | 2020-02-06 | — | — | WO | disclosed |