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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 11/20 | 0.62 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
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 SCHEMBL14237107 | 1.00 | CCR2 (0.62) | CCR2OPRM1GRIN2BOPRD1OPRL1 | |
| Bicarbonate SCHEMBL14237203 | 0.85 | CCR2 (0.63) | CCR2OPRM1GRIN2BOPRD1OPRL1 | |
| Bicarbonate SCHEMBL14237150 | 0.85 | CCR2 (0.63) | CCR2OPRM1GRIN2BOPRD1OPRL1 | |
| Bicarbonate SCHEMBL14237270 | 0.81 | CCR2 (0.48) | CCR2OPRM1GRIN2BOPRD1OPRL1 | |
| Bicarbonate SCHEMBL14237136 | 0.81 | CCR2 (0.66) | CCR2OPRM1GRIN2BOPRD1OPRL1 | |
| Bicarbonate SCHEMBL14237079 | 0.81 | CCR2 (0.47) | CCR2 | |
| Bicarbonate SCHEMBL14237114 | 0.79 | CCR2 (0.61) | CCR2OPRM1GRIN2BOPRL1 | |
| Bicarbonate SCHEMBL14237147 | 0.78 | CCR2 (0.57) | CCR2 | |
| SCHEMBL14237157 | 0.78 | CCR2 (0.61) | CCR2 | |
| SCHEMBL1781364 | 0.77 | CCR2 (1.00) | CCR2 |
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-2318352-B1 | CYCLOHEXENYL COMPOUNDS AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL MYERS SQUIBB CO (US) | 2012-12-19 | — | — | EP | claimed |