Known targets — ChEMBL curated mechanism
BTKCACNA1CCACNA1DCACNA1FCACNA1SCACNA2D1CACNA2D2DRD2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQHRH1HTR2AP2RY12
The experimentally established mechanism targets of None. 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 | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PAM | P19021 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP7 | P09237 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL168709 | 0.79 | — | — | |
| SCHEMBL9243189 | 0.79 | ALOX15 (0.47) | SMN1; SMN2TSHRPOLBALOX15ALDH1A1 | |
| Malonic Acid SCHEMBL20594155 | 0.78 | SMN1; SMN2 (0.73) | SMN1; SMN2TSHRPOLBCYP2D6ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL11317665 | 0.77 | TSHR (0.39) | TSHRPOLBALOX15ALDH1A1 | |
| Bicarbonate SCHEMBL15282245 | 0.77 | TSHR (0.89) | SMN1; SMN2TSHRPOLBCYP2D6ALDH1A1 | |
| Methane SCHEMBL9595604 | 0.77 | TSHR (0.39) | TSHRPOLBALOX15ALDH1A1 | |
| SCHEMBL28279642 | 0.77 | TSHR (0.39) | TSHRPOLBALOX15ALDH1A1 | |
| SCHEMBL11280732 | 0.77 | TSHR (0.39) | TSHRPOLBALOX15ALDH1A1 | |
| SCHEMBL27845788 | 0.77 | TSHR (0.39) | TSHRPOLBALOX15ALDH1A1 | |
| Bicarbonate SCHEMBL28272077 | 0.77 | TSHR (0.89) | SMN1; SMN2TSHRPOLBCYP2D6ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2289970-B1 | Biocompatible polymers | BARRITAULT DENIS (FR) | 2015-05-20 | — | — | EP | disclosed |
| EP-1117695-B1 | BIOCOMPATIBLE POLYMERS, COMPOSITIONS CONTAINING SAME AND THEIR USE FOR THE MANUFACTURE OF DRUGS | BARRITAULT DENIS (FR) | 2015-05-20 | — | — | EP | disclosed |
| EP-2289970-A1 | Biocompatible polymers, their process of manufacture and compositions containing them | Barritault, Denis (FR) | 2011-03-02 | — | — | EP | disclosed |