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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.44 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HNF4A | P41235 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30359283 | 0.93 | SMN1; SMN2 (0.51) | ALDH1A1KDM4ESMN1; SMN2ESR2HIF1A | |
| SCHEMBL769515 | 0.93 | SMN1; SMN2 (0.51) | ALDH1A1KDM4ESMN1; SMN2ESR2HIF1A | |
| Methane SCHEMBL28932814 | 0.91 | SMN1; SMN2 (0.50) | ALDH1A1KDM4ESMN1; SMN2ESR2HIF1A | |
| SCHEMBL30513178 | 0.89 | ESR2 (0.52) | ALDH1A1KDM4ESMN1; SMN2ESR2HIF1A | |
| Bicarbonate SCHEMBL11598084 | 0.89 | ESR2 (0.41) | ALDH1A1KDM4ESMN1; SMN2ESR2HIF1A | |
| SCHEMBL820505 | 0.89 | ESR2 (0.48) | ALDH1A1KDM4ESMN1; SMN2ESR2HIF1A | |
| Phenol SCHEMBL27481064 | 0.88 | ESR2 (0.61) | ALDH1A1KDM4ESMN1; SMN2ESR2HIF1A | |
| SCHEMBL18411428 | 0.85 | SMN1; SMN2 (0.49) | ALDH1A1KDM4ESMN1; SMN2ESR2HIF1A | |
| SCHEMBL11390415 | 0.84 | ALDH1A1 (0.50) | ALDH1A1KDM4ESMN1; SMN2ESR2HIF1A | |
| SCHEMBL18411358 | 0.82 | SMN1; SMN2 (0.46) | ALDH1A1KDM4ESMN1; SMN2ESR2HIF1A |
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-20020115793-A1 | Methods of making telechelic oligomers, methods of making block copolymers, and novel block copolymers | GAGNE MICHEL R (US) | 2002-08-22 | — | — | US | claimed |
| US-6642322-B2 | Reacting a substrate compound selected from polycarbonate, polyester, polyurethanes, polylactones with a chain transfer agent to form telechelic oligomers in presence of alkali metal catalyst; living free radical polymerization | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL | 2003-11-04 | — | — | US | disclosed |
| US-20020115793-A1 | Methods of making telechelic oligomers, methods of making block copolymers, and novel block copolymers | GAGNE MICHEL R (US) | 2002-08-22 | — | — | US | disclosed |