Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | CASP7 | P55210 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | RGS12 | O14924 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29771748 | 0.85 | TDP2 (0.46) | GSK3BPARP1CYP3A4TDP1CASP7 | |
| SCHEMBL27945930 | 0.82 | PARP1 (0.54) | GSK3BPARP1CYP3A4TDP1CASP7 | |
| SCHEMBL135332 | 0.82 | GSK3B (0.56) | GSK3BPARP1CASP7MEN1POLB | |
| SCHEMBL2894929 | 0.81 | ALDH1A1 (0.46) | GSK3BPARP1TDP1MEN1MAPT | |
| SCHEMBL27453645 | 0.81 | ALDH1A1 (0.46) | GSK3BPARP1CASP7MEN1POLB | |
| SCHEMBL30956736 | 0.81 | CASP3 (0.48) | GSK3BPARP1CYP3A4TDP1CASP7 | |
| SCHEMBL29032840 | 0.81 | GSK3B (0.54) | GSK3BPARP1CASP7MEN1POLB | |
| Ammonia Solution, Strong SCHEMBL28821133 | 0.81 | GSK3B (0.54) | GSK3BPARP1CASP7MEN1POLB | |
| SCHEMBL16754925 | 0.80 | GSK3B (0.62) | GSK3BPARP1CYP3A4TDP1CASP7 | |
| SCHEMBL9016868 | 0.79 | GSK3B (0.50) | GSK3BPARP1CYP3A4TDP1CASP7 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111606850-B | Preparation method of bedaquiline and intermediate thereof | 安徽贝克生物制药有限公司 | 2023-07-25 | — | — | CN | disclosed |
| CN-110628025-B | Polyimide precursor, polyimide, and material for use in production thereof | 宇部兴产株式会社 | 2022-07-12 | — | — | CN | disclosed |
| CN-110628025-A | Polyimide precursor, polyimide, and material for use in preparation thereof | 宇部兴产株式会社 | 2019-12-31 | — | — | CN | disclosed |
| EP-0482508-B1 | Biscationic azo dyes and their intermediates | BASF AG (DE) | 1995-07-12 | — | — | EP | disclosed |
| US-5424404-A | Colorfastness, discoloration inhibition, red and yellow color; coloring paper, leather, printing on polymeric material | BASF AKTIENGESELLSCHAFT (DE) | 1995-06-13 | — | — | US | disclosed |
| EP-0482508-A1 | Biscationic azo dyes and their intermediates | BASF Aktiengesellschaft (DE) | 1992-04-29 | — | — | EP | disclosed |
| US-4136033-A | DIAZO COUPLERS | SANDOZ LTD. (CH) | 1979-01-23 | — | — | US | disclosed |