Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28724239 | 1.00 | TDP1 (0.42) | TDP1CYP3A4ALOX15SMN1; SMN2TP53 | |
| SCHEMBL1491739 | 0.82 | CYP3A4 (0.48) | TDP1CYP3A4ALOX15SMN1; SMN2TP53 | |
| SCHEMBL24073372 | 0.82 | HPGD (0.33) | TDP1CYP3A4ALOX15SMN1; SMN2TP53 | |
| SCHEMBL1491726 | 0.80 | TSHR (0.46) | TDP1CYP3A4ALOX15SMN1; SMN2TP53 | |
| SCHEMBL1491735 | 0.80 | ALDH1A1 (0.46) | ALDH1A1HPGD | |
| SCHEMBL26602806 | 0.80 | CA12 (0.44) | TDP1CYP3A4ALDH1A1TSHRHPGD | |
| SCHEMBL16995973 | 0.80 | ALOX15 (0.46) | TDP1CYP3A4ALOX15SMN1; SMN2THRB | |
| SCHEMBL1491734 | 0.79 | POLB (0.43) | ALDH1A1HPGDMAPTGAAPOLB | |
| SCHEMBL1491622 | 0.77 | ALDH1A1 (0.52) | TDP1CYP3A4SMN1; SMN2TP53THRB | |
| SCHEMBL1491772 | 0.77 | ALDH1A1 (0.53) | TDP1CYP3A4THRBMEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116134025-B | Amide phosphine oxide derivative and preparation method and application thereof | 浙江海正药业股份有限公司 | 2025-04-04 | — | — | CN | disclosed |
| CN-114315899-B | 3- (Aromatic ring imidazole) pyrazolopyrimidine derivative and application thereof | 上海美迪西生物医药股份有限公司 | 2024-09-03 | — | — | CN | disclosed |
| CN-116134025-A | Amide phosphine oxide derivative and preparation method and application thereof | 浙江海正药业股份有限公司 | 2023-05-16 | — | — | CN | disclosed |
| CN-114315899-A | 3- (aromatic benzimidazolyl) pyrazolopyrimidine derivative and application thereof | 上海美迪西生物医药股份有限公司 | 2022-04-12 | — | — | CN | disclosed |
| WO-2022057858-A1 | AMIDE PHOSPHINE OXIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF | 浙江海正药业股份有限公司 | 2022-03-24 | — | — | WO | disclosed |