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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL11809949 | 0.91 | SMN1; SMN2 (0.44) | KDM4EMAPTLMNAHTTKMT2A | |
| Methyl Alcohol SCHEMBL28197604 | 0.87 | POLB (0.43) | KDM4EMAPTLMNAHTTKMT2A | |
| SCHEMBL51447 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL5909839 | 0.84 | POLB (0.46) | LMNAHTTKMT2ASMN1; SMN2MAPK1 | |
| SCHEMBL4288196 | 0.82 | SMN1; SMN2 (0.46) | KDM4EMAPTLMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL14231220 | 0.78 | SMN1; SMN2 (0.39) | KDM4EMAPTLMNAHTTSMN1; SMN2 | |
| Methylthiouracil SCHEMBL503305 | 0.75 | — | — | |
| SCHEMBL3633436 | 0.74 | SMN1; SMN2 (0.50) | KDM4EMAPTLMNAHTTKMT2A | |
| SCHEMBL5697745 | 0.74 | — | — | |
| Bicarbonate SCHEMBL9343614 | 0.74 | NOS3 (0.50) | KDM4EMAPTLMNAHTTKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3940382-A | BACTERICIDE | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JA) | 1976-02-24 | — | — | US | disclosed |
| US-3939143-A | BACTERICIDE | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JA) | 1976-02-17 | — | — | US | disclosed |
| US-3936452-A | Process of producing pyrimidyl thiocarbonates | NITTO BOSEKI CO., LTD. (JA) | 1976-02-03 | — | — | US | disclosed |