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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 1/20 | 0.33 |
| ▸ | ITK | Q08881 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.30 |
| ▸ | RXRG | P48443 | 1/20 | 0.30 |
| ▸ | SGMS1 | Q86VZ5 | 1/20 | 0.30 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.30 |
| ▸ | ELANE | P08246 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1897774 | 0.93 | TAS2R14 (0.34) | CETPCXCR3 | |
| Bicarbonate SCHEMBL5217034 | 0.93 | TACR1 (0.36) | CETPTACR1CXCR3SGMS1SGMS2 | |
| SCHEMBL4828826 | 0.93 | TAS2R14 (0.34) | CETPCXCR3 | |
| Hydrochloric Acid SCHEMBL1903284 | 0.92 | CETP (0.33) | CETPCXCR3 | |
| Bicarbonate SCHEMBL5183776 | 0.92 | TACR1 (0.36) | CETPTACR1CXCR3SGMS1SGMS2 | |
| SCHEMBL3539947 | 0.91 | CETP (0.34) | CETPCXCR3 | |
| Hydrochloric Acid SCHEMBL1900943 | 0.90 | CETP (0.34) | CETPITK | |
| SCHEMBL1899995 | 0.90 | CETP (0.34) | CETPITKELANE | |
| SCHEMBL1902292 | 0.88 | CETP (0.34) | CETPELANE | |
| Bicarbonate SCHEMBL5192359 | 0.88 | CETP (0.32) | CETPTACR1CXCR3SGMS1SGMS2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1533292-B1 | DIBENZYLAMINE COMPOUND AND MEDICINAL USE THEREOF | JAPAN TOBACCO INC (JP) | 2007-02-14 | — | — | EP | claimed |