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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 5/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | HTR2A | P28223 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL2360922 | 0.91 | LMNA (0.32) | NPSR1GAALMNAPOLBSMN1; SMN2 | |
| Bicarbonate SCHEMBL2362534 | 0.90 | NPSR1 (0.38) | NPSR1GAALMNAPOLBSMN1; SMN2 | |
| SCHEMBL2362312 | 0.82 | LMNA (0.32) | NPSR1GAALMNAPOLB | |
| Bicarbonate SCHEMBL2362304 | 0.80 | GAA (0.37) | GAALMNAPOLBHTR2AHTR2C | |
| SCHEMBL1194663 | 0.78 | LMNA (0.46) | GAALMNAPOLBPKMALPL | |
| SCHEMBL314811 | 0.76 | GAA (0.40) | NPSR1GAALMNAPOLBSMN1; SMN2 | |
| SCHEMBL18049616 | 0.74 | IRAK4 (0.41) | GAALMNAPOLB | |
| SCHEMBL2362833 | 0.74 | LMNA (0.33) | NPSR1GAALMNAPOLBSMN1; SMN2 | |
| SCHEMBL12887765 | 0.71 | GAA (0.33) | GAALMNAPOLB | |
| SCHEMBL6021823 | 0.70 | NPSR1 (0.34) | NPSR1LMNASMN1; SMN2NPC1PKM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2352723-A2 | HALOGEN-SUBSTITUTED COMPOUNDS USED AS PESTICIDES | Bayer CropScience AG (DE) | 2011-08-10 | — | — | EP | disclosed |
| WO-2010051926-A2 | NEW HALOGEN-SUBSTITUTED BONDS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2010-05-14 | — | — | WO | disclosed |