Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.38 |
| ▸ | EBP | Q15125 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 3/20 | 0.35 |
| ▸ | DRD2 | P14416 | 3/20 | 0.35 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | HTR2B | P41595 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7508309 | 0.99 | SIGMAR1 (0.37) | SIGMAR1TMEM97EBPDRD3DRD2 | |
| SCHEMBL8329033 | 0.81 | SIGMAR1 (0.42) | SIGMAR1TMEM97EBPTSHRCYP2D6 | |
| Hydrochloric Acid SCHEMBL7310901 | 0.81 | SIGMAR1 (0.41) | SIGMAR1TMEM97EBPTSHRCYP2D6 | |
| SCHEMBL7144481 | 0.80 | SIGMAR1 (0.38) | SIGMAR1TMEM97EBPTSHRHPGD | |
| SCHEMBL29412738 | 0.79 | SIGMAR1 (0.56) | SIGMAR1TMEM97EBPTSHRCYP2D6 | |
| SCHEMBL7325355 | 0.79 | SIGMAR1 (0.56) | SIGMAR1TMEM97EBPTSHRCYP2D6 | |
| Hydrochloric Acid SCHEMBL9148670 | 0.78 | SIGMAR1 (0.55) | SIGMAR1TMEM97EBPTSHRCYP2D6 | |
| SCHEMBL7135842 | 0.73 | SIGMAR1 (0.41) | SIGMAR1TMEM97EBPTSHRCYP2D6 | |
| SCHEMBL7142941 | 0.73 | DRD2 (0.36) | DRD3DRD2DRD4TSHRKMT2A | |
| SCHEMBL8652251 | 0.72 | ALDH1A1 (0.38) | SIGMAR1TMEM97EBPDRD3DRD2 |
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-1192122-B1 | BENZENE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | SANOFI SYNTHELABO (FR) | 2003-10-22 | — | — | EP | disclosed |
| EP-1192122-A1 | BENZENE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | SANOFI-SYNTHELABO (FR) | 2002-04-03 | — | — | EP | disclosed |
| WO-2000076953-A1 | BENZENE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | SANOFI-SYNTHELABO (FR) | 2000-12-21 | — | — | WO | disclosed |