Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB8 | P28062 | 8/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | AXL | P30530 | 1/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1761836 | 1.00 | PSMB8 (0.50) | PSMB8KDM4EALDH1A1HPGDCYP3A4 | |
| SCHEMBL341252 | 0.75 | PDE3B (0.49) | ALDH1A1AURKAPARP1DAO | |
| SCHEMBL30775064 | 0.69 | PSMB8 (0.48) | PSMB8KDM4EALDH1A1HPGDCYP3A4 | |
| SCHEMBL1002214 | 0.69 | PSMB8 (0.48) | PSMB8KDM4EALDH1A1HPGDCYP3A4 | |
| 2-Mercaptobenzothiazole SCHEMBL29433968 | 0.67 | PSMB8 (1.00) | PSMB8KDM4EALDH1A1HPGDCYP3A4 | |
| 2-Mercaptobenzothiazole SCHEMBL408087 | 0.67 | PSMB8 (1.00) | PSMB8KDM4EALDH1A1HPGDCYP3A4 | |
| 2-Mercaptobenzothiazole SCHEMBL4268289 | 0.65 | PSMB8 (0.95) | PSMB8KDM4EALDH1A1HPGDCYP3A4 | |
| 2-Mercaptobenzothiazole SCHEMBL29729650 | 0.65 | PSMB8 (0.95) | PSMB8KDM4EALDH1A1HPGDCYP3A4 | |
| 2-Mercaptobenzothiazole SCHEMBL8749352 | 0.65 | PSMB8 (0.95) | PSMB8KDM4EALDH1A1HPGDCYP3A4 | |
| 2-Mercaptobenzothiazole SCHEMBL5934103 | 0.65 | PSMB8 (0.95) | PSMB8KDM4EALDH1A1HPGDCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115260164-B | Preparation method, structural composition and application of novel 4 (3H) -quinazolinone analogue in antitumor drugs | 杭州星鳌生物科技有限公司 | 2024-03-26 | — | — | CN | disclosed |
| CN-113717201-B | (+/-) -Marinopyrole A derivative and preparation method and application thereof | 植恩生物技术股份有限公司 | 2022-12-16 | — | — | CN | disclosed |
| WO-2022233253-A1 | METHOD FOR PREPARING NEW 4(3H)-QUINAZOLINONE ANALOG, STRUCTURAL COMPOSITION THEREOF, AND USE THEREOF IN ANTITUMOR DRUGS | 杭州星鳌生物科技有限公司 | 2022-11-10 | — | — | WO | disclosed |
| CN-115260164-A | Preparation method and structural composition of novel 4 (3H) -quinazolinone analogue and application of analogue in antitumor drugs | 杭州星鳌生物科技有限公司 | 2022-11-01 | — | — | CN | disclosed |