Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 6/20 | 0.38 |
| ▸ | MTOR | P42345 | 5/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.34 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.34 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15169040 | 0.86 | AR (0.40) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL15179487 | 0.84 | CYP1A2 (0.46) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL324081 | 0.84 | CYP1A2 (0.46) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL15168429 | 0.83 | CYP1A2 (0.46) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL15168048 | 0.83 | CYP1A2 (0.46) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL325111 | 0.82 | CNR2 (0.49) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL15168744 | 0.82 | CNR2 (0.49) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL16199555 | 0.81 | CYP1A2 (0.37) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL16199558 | 0.75 | PRMT1 (0.45) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL10239578 | 0.75 | PRMT1 (0.45) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 |
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-2012004604-A1 | TETRAZOLE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS | Convergence Pharmaceuticals Limited (GB) | 2012-01-12 | — | — | WO | disclosed |