Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DCPS | Q96C86 | 14/20 | 0.61 |
| ▸ | DHFR | P00374 | 6/20 | 0.61 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4003593 | 0.99 | DCPS (0.60) | DCPSDHFRMCHR1KCNH2CYP2D6 | |
| SCHEMBL4004431 | 0.93 | DCPS (0.59) | DCPSDHFRMCHR1KCNH2CYP2D6 | |
| SCHEMBL4005326 | 0.91 | DCPS (0.58) | DCPSDHFRMCHR1KCNH2CYP2D6 | |
| SCHEMBL1154891 | 0.87 | DCPS (0.79) | DCPSDHFRMCHR1CYP2D6 | |
| SCHEMBL1154212 | 0.86 | DCPS (0.77) | DCPSDHFRMCHR1CYP2D6 | |
| SCHEMBL1155035 | 0.84 | DCPS (0.79) | DCPSDHFRMCHR1CYP2D6 | |
| SCHEMBL1154903 | 0.81 | DCPS (0.83) | DCPSDHFRCYP2D6 | |
| SCHEMBL16863977 | 0.78 | DCPS (0.63) | DCPSDHFRKCNH2 | |
| SCHEMBL6015540 | 0.77 | DCPS (0.47) | DCPSDHFRMCHR1CYP2D6 | |
| SCHEMBL2165928 | 0.77 | DCPS (0.71) | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1765810-A1 | 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY | Decode Chemistry, Inc. (US) | 2007-03-28 | — | — | EP | claimed |
| WO-2005123724-A1 | 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY | DECODE CHEMISTRY, INC. (US) | 2005-12-29 | — | — | WO | claimed |
| EP-1765810-A1 | 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY | Decode Chemistry, Inc. (US) | 2007-03-28 | — | — | EP | disclosed |
| WO-2005123724-A1 | 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY | DECODE CHEMISTRY, INC. (US) | 2005-12-29 | — | — | WO | disclosed |