Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 8/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5217387 | 0.85 | CASR (0.41) | CASRKCNH2LMNAMAPTTSHR | |
| SCHEMBL1154474 | 0.84 | CYP11B1 (0.43) | LMNAMAPTTSHRHTT | |
| SCHEMBL5224566 | 0.83 | MAPK14 (0.47) | CASRSLC6A4LMNAMAPTTSHR | |
| SCHEMBL5221531 | 0.82 | CASR (0.41) | CASRCYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5222695 | 0.81 | MAPK14 (0.40) | CASRSLC6A4LMNAMAPTTSHR | |
| SCHEMBL5219798 | 0.81 | TAAR1 (0.48) | SLC6A4 | |
| SCHEMBL5220371 | 0.81 | HTR2C (0.44) | CASRCYP2D6SLC6A4 | |
| SCHEMBL1154302 | 0.80 | LMNA (0.43) | CASRKCNH2LMNAMAPTTSHR | |
| SCHEMBL1155054 | 0.80 | NPC1 (0.52) | CASRSLC6A4LMNAMAPTTSHR | |
| SCHEMBL5217026 | 0.80 | MAOB (0.42) | CASRCYP2D6LMNAMAPTTSHR |
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 2 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 | disclosed |
| WO-2005123724-A1 | 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY | DECODE CHEMISTRY, INC. (US) | 2005-12-29 | — | — | WO | disclosed |