Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3A | Q14432 | 3/20 | 0.50 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.50 |
| ▸ | DCPS | Q96C86 | 1/20 | 0.44 |
| ▸ | DHFR | P00374 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2948476 | 0.83 | PDE3B (0.53) | PDE3APDE3BMEN1ALDH1A1HPGD | |
| SCHEMBL14353311 | 0.83 | DCPS (0.63) | PDE3APDE3BDCPSDHFRMEN1 | |
| SCHEMBL25347027 | 0.82 | PDE3A (0.51) | PDE3APDE3BDCPSDHFRMEN1 | |
| SCHEMBL11212954 | 0.81 | PDE5A (0.43) | DCPSDHFRALDH1A1 | |
| SCHEMBL10758183 | 0.81 | PDE3A (0.47) | PDE3APDE3BDCPSDHFRMEN1 | |
| SCHEMBL8899181 | 0.79 | DCPS (0.71) | DCPSDHFRALDH1A1HPGDACHE | |
| SCHEMBL16689302 | 0.76 | CFD (0.47) | DCPSDHFRALDH1A1AMY1A | |
| SCHEMBL10956249 | 0.74 | ALDH1A1 (0.47) | DHFRMEN1ALDH1A1MAPTHPGD | |
| SCHEMBL6764928 | 0.74 | ALDH1A1 (0.40) | DCPSDHFRALDH1A1 | |
| SCHEMBL16689309 | 0.74 | CFD (0.45) | DCPSDHFRALDH1A1 |
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-2008084493-A2 | A NOVEL PROCESS FOR THE PREPARATION OF 2-HALO-4-AMINOQUINAZOLINES | UNICHEM LABORATORIES LIMITED (IN) | 2008-07-17 | — | — | WO | disclosed |