Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DCPS | Q96C86 | 16/20 | 0.68 |
| ▸ | DHFR | P00374 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1154676 | 0.88 | DCPS (0.66) | DCPSDHFRCYP2D6KCNH2 | |
| SCHEMBL2164706 | 0.86 | DCPS (0.70) | DCPSDHFRCYP2D6 | |
| SCHEMBL2164648 | 0.86 | DCPS (0.70) | DCPSDHFRCYP2D6 | |
| SCHEMBL2166003 | 0.85 | DCPS (0.81) | DCPSDHFRCYP2D6 | |
| SCHEMBL2166718 | 0.85 | DCPS (0.71) | DCPSDHFRCYP2D6 | |
| SCHEMBL10251547 | 0.84 | DCPS (0.51) | DCPSDHFRCYP2D6 | |
| SCHEMBL2164903 | 0.84 | DCPS (0.66) | DCPSDHFRCYP2D6 | |
| SCHEMBL2165530 | 0.84 | DCPS (0.71) | DCPSDHFRCYP2D6 | |
| SCHEMBL2164721 | 0.84 | DCPS (0.74) | DCPSDHFRCYP2D6 | |
| SCHEMBL2164526 | 0.84 | DCPS (0.68) | DCPSDHFRCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-7985755-B2 | 2,4-diaminoquinazolines for spinal muscular atrophy | FAMILIES OF SPINAL MUSCULAR ATROPHY (US) | 2011-07-26 | — | — | US | claimed |