Known targets — ChEMBL curated mechanism
BTKCACNA1CCACNA1DCACNA1FCACNA1SCACNA2D1CACNA2D2DRD2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQHRH1HTR2AP2RY12
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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.76 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | NT5E | P21589 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA4 | P22748 | 2/20 | 0.46 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.46 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.46 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | SNCA | P37840 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL19457644 | 0.91 | TSHR (0.70) | TSHRSMN1; SMN2POLBCYP2D6LMNA | |
| Sulfuric Acid SCHEMBL28853987 | 0.91 | TSHR (0.70) | TSHRSMN1; SMN2POLBCYP2D6LMNA | |
| Sulfuric Acid SCHEMBL6374630 | 0.88 | TSHR (0.80) | TSHRSMN1; SMN2POLBCYP2D6LMNA | |
| Sulfuric Acid SCHEMBL6374621 | 0.88 | TSHR (0.80) | TSHRSMN1; SMN2POLBCYP2D6LMNA | |
| Sulfuric Acid SCHEMBL28079923 | 0.88 | TSHR (0.80) | TSHRSMN1; SMN2POLBCYP2D6LMNA | |
| Hydrochloric Acid SCHEMBL27748505 | 0.87 | TSHR (0.89) | TSHRSMN1; SMN2POLBCYP2D6LMNA | |
| Bicarbonate SCHEMBL28272077 | 0.87 | TSHR (0.89) | TSHRSMN1; SMN2POLBCYP2D6LMNA | |
| Bicarbonate SCHEMBL15282245 | 0.87 | TSHR (0.89) | TSHRSMN1; SMN2POLBCYP2D6LMNA | |
| Benzene SCHEMBL9751882 | 0.87 | TSHR (1.00) | TSHRSMN1; SMN2POLBCYP2D6LMNA | |
| SCHEMBL3409457 | 0.87 | TSHR (1.00) | TSHRSMN1; SMN2POLBCYP2D6LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-105948019-A | Preparation method of peanut shell based foam carbon | 陈毅忠 | 2016-09-21 | — | — | CN | disclosed |
| CN-103827093-B | The crystal of 5-hydroxyl-1H-imidazoles-4-Methanamide hydrate and the crystal of 5-hydroxyl-1H-imidazoles-4-Methanamide 3/4 hydrate and manufacture method thereof | 富士胶片株式会社 | 2016-06-15 | — | — | CN | disclosed |