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 | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | TYR | P14679 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.47 |
| ▸ | PTPRC | P08575 | 1/20 | 0.46 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
| ▸ | PTPRB | P23467 | 1/20 | 0.46 |
| ▸ | PTPRE | P23469 | 1/20 | 0.46 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.46 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.46 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31375351 | 0.91 | TYR (0.58) | ENPP2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL48994 | 0.91 | TYR (0.58) | ENPP2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28298713 | 0.91 | TYR (0.58) | ENPP2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL31375356 | 0.91 | TYR (0.58) | ENPP2KDM4EALDH1A1HPGDHSD17B10 | |
| Hydrochloric Acid SCHEMBL4625112 | 0.89 | TYR (0.56) | ENPP2KDM4EALDH1A1HPGDHSD17B10 | |
| Bromide SCHEMBL29769307 | 0.89 | TYR (0.56) | ENPP2KDM4EALDH1A1HPGDHSD17B10 | |
| Bromide SCHEMBL27546379 | 0.89 | TYR (0.56) | ENPP2KDM4EALDH1A1HPGDHSD17B10 | |
| Sulfuric Acid SCHEMBL9312939 | 0.86 | TYR (0.48) | ENPP2KDM4EALDH1A1HPGDHSD17B10 | |
| Catechol SCHEMBL7624422 | 0.83 | ALOX15 (0.50) | ENPP2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9279858 | 0.83 | GPR35 (0.75) | ENPP2KDM4EALDH1A1HPGDHSD17B10 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1405627-B1 | Antipenetrating hair pretreatment composition based on polyethelenoxide polymer(s) and process using said composition for limiting skin penetration by colourants | OREAL (FR) | 2008-04-30 | — | — | EP | claimed |
| EP-1404762-B1 | A METHOD OF COLORING HAIR USING CATIONIC DYES | BASF SE (DE) | 2009-11-25 | — | — | EP | disclosed |
| US-7078498-B2 | Method of coloring hair using cationic dyes | CIBE SPECIALTY CHEMICALS CORPORATION (US) | 2006-07-18 | — | — | US | disclosed |
| US-6949630-B2 | Cationic reactive dyes | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2005-09-27 | — | — | US | disclosed |
| EP-1404762-A1 | A METHOD OF COLORING HAIR USING CATIONIC DYES | Ciba SC Holding AG (CH) | 2004-04-07 | — | — | EP | disclosed |
| WO-2003006554-A1 | A METHOD OF COLORING HAIR USING CATIONIC DYES | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2003-01-23 | — | — | WO | disclosed |