Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 7/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | STAT1 | P42224 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | TP53 | P04637 | 4/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28460284 | 0.92 | FDPS (0.50) | MEN1KMT2AHPGDALDH1A1 | |
| SCHEMBL28452461 | 0.92 | MEN1 (0.46) | MEN1KMT2ARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL7730987 | 0.90 | ADORA2A (0.51) | MEN1KMT2ARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL7730989 | 0.90 | ADORA2A (0.51) | MEN1KMT2ARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL28458573 | 0.88 | FDPS (0.44) | MEN1KMT2AKDM4EHPGDALDH1A1 | |
| SCHEMBL28377498 | 0.87 | ALDH1A1 (0.44) | MEN1KMT2ARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL28371613 | 0.87 | ALDH1A1 (0.44) | MEN1KMT2ARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL28429042 | 0.86 | HDAC3 (0.39) | MEN1KMT2ARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL28372708 | 0.86 | PDE4D (0.45) | MEN1KMT2ASMN1; SMN2KDM4EHPGD | |
| SCHEMBL28887208 | 0.83 | ALDH1A1 (0.42) | MEN1KMT2ARAB9ANPC1KDM4E |
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-117088882-A | Method for preparing high-purity itraconazole intermediate | 山东新华制药股份有限公司 | 2023-11-21 | — | — | CN | claimed |
| CN-117088882-A | Method for preparing high-purity itraconazole intermediate | 山东新华制药股份有限公司 | 2023-11-21 | — | — | CN | disclosed |
| CN-117088882-A | Method for preparing high-purity itraconazole intermediate | 山东新华制药股份有限公司 | 2023-11-21 | — | — | CN | disclosed |
| CN-117024428-A | Novel method for synthesizing itratheophylline | 山东新华制药股份有限公司 | 2023-11-10 | — | — | CN | disclosed |