Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE8A | O60658 | 1/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 3/20 | 0.31 |
| ▸ | ACHE | P22303 | 3/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 2/20 | 0.31 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11607410 | 0.83 | KMT2A (0.43) | PDE8APDE5AHTTMAPTSMN1; SMN2 | |
| SCHEMBL17873539 | 0.83 | HTT (0.41) | PDE8APDE5AHTTBCHEACHE | |
| SCHEMBL10956859 | 0.76 | PDE5A (0.45) | PDE8APDE5AHTTCDK1DHFR | |
| SCHEMBL9038418 | 0.74 | PDE5A (0.64) | PDE5ASMN1; SMN2DHFRGAA | |
| SCHEMBL16689293 | 0.72 | PDE5A (0.53) | PDE5ASMN1; SMN2DHFRGAA | |
| SCHEMBL8900322 | 0.71 | HTT (0.58) | HTTBCHEACHECHRM1DHFR | |
| SCHEMBL27303786 | 0.70 | NPC1 (0.41) | PDE5AHTTACHEMAPTSMN1; SMN2 | |
| SCHEMBL16689306 | 0.70 | PDE5A (0.50) | PDE5AHTTDHFR | |
| SCHEMBL16689313 | 0.70 | PDE5A (0.50) | PDE5A | |
| SCHEMBL14391601 | 0.68 | HTT (0.39) | HTTACHEMAPTSMN1; SMN2CDK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3960735-B1 | QUINAZOLINE DERIVATIVES USED TO TREAT HIV | GILEAD SCIENCES INC (US) | 2023-09-13 | — | — | EP | disclosed |