Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.33 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | STS | P08842 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25308811 | 0.86 | CYP2D6 (0.38) | CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3 | |
| SCHEMBL25308814 | 0.86 | CYP2D6 (0.38) | CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3 | |
| SCHEMBL962353 | 0.86 | CYP2D6 (0.39) | CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3 | |
| SCHEMBL23151947 | 0.84 | CYP2D6 (0.40) | CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3 | |
| SCHEMBL7032005 | 0.83 | CYP2D6 (0.45) | CYP2D6CYP1A2KMT2ASTAT3ALDH1A1 | |
| SCHEMBL26655196 | 0.83 | CYP2D6 (0.45) | CYP2D6CYP1A2KMT2ASTAT3ALDH1A1 | |
| SCHEMBL26655167 | 0.83 | CYP2D6 (0.45) | CYP2D6CYP1A2KMT2ASTAT3ALDH1A1 | |
| SCHEMBL7166740 | 0.83 | CYP2D6 (0.45) | CYP2D6CYP1A2KMT2ASTAT3ALDH1A1 | |
| SCHEMBL25308618 | 0.82 | CYP2D6 (0.40) | CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3 | |
| SCHEMBL25307247 | 0.82 | CYP2D6 (0.40) | CYP2D6CYP1A2KMT2ASMN1; SMN2STAT3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012025857-A1 | CYCLOALKYL METHOXYBENZYL PHENYL PYRAN DERIVATIVES AS SODIUM DEPENDENT GLUCOSE CO TRANSPORTER (SGLT2) INHIBITORS | HETERO RESEARCH FOUNDATION (IN) | 2012-03-01 | — | — | WO | disclosed |