Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DCPS | Q96C86 | 1/20 | 0.72 |
| ▸ | DHFR | P00374 | 4/20 | 0.50 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrazine SCHEMBL29011033 | 0.85 | DCPS (0.91) | DCPSDHFRNUDT1ALDH1A1HPGD | |
| SCHEMBL269636 | 0.85 | DCPS (1.00) | DCPSDHFRNUDT1ALDH1A1HPGD | |
| SCHEMBL29375878 | 0.85 | DCPS (1.00) | DCPSDHFRNUDT1ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL27786605 | 0.83 | DCPS (0.95) | DCPSDHFRNUDT1ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL6601650 | 0.83 | DCPS (0.95) | DCPSDHFRNUDT1ALDH1A1HPGD | |
| SCHEMBL30468763 | 0.83 | DCPS (0.95) | DCPSDHFRNUDT1ALDH1A1HPGD | |
| SCHEMBL29011023 | 0.76 | DCPS (0.62) | DCPSDHFRNUDT1ALDH1A1HPGD | |
| Pyrrole SCHEMBL5652472 | 0.69 | DCPS (0.66) | DCPSDHFRNUDT1ALDH1A1HPGD | |
| SCHEMBL9605513 | 0.67 | DHFR (1.00) | DCPSDHFRNUDT1ADORA2AHRH4 | |
| SCHEMBL12545043 | 0.67 | PDE5A (0.59) | DCPSDHFRALDH1A1HPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113845548-B | Platinum complex of quinazoline hydrazine dithioformate and preparation method and application thereof | 深圳大学 | 2023-06-06 | — | — | CN | disclosed |