Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.58 |
| ▸ | HPGD | P15428 | 4/20 | 0.58 |
| ▸ | TSHR | P16473 | 4/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | HPRT1 | P00492 | 4/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | AHR | P35869 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18600581 | 0.90 | HSD17B10 (0.58) | HSD17B10ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL16194308 | 0.88 | ALDH1A1 (0.60) | HSD17B10ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL31158232 | 0.85 | ALDH1A1 (0.65) | HSD17B10ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL3630203 | 0.85 | ALDH1A1 (0.65) | HSD17B10ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL18600593 | 0.84 | ALDH1A1 (0.52) | HSD17B10ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL1038972 | 0.84 | HPRT1 (0.72) | HSD17B10ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL29697319 | 0.84 | HPRT1 (0.72) | HSD17B10ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL29518611 | 0.83 | ALDH1A1 (0.62) | HSD17B10ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL28712139 | 0.83 | ALDH1A1 (0.62) | HSD17B10ALDH1A1HPGDTSHRCYP3A4 | |
| SCHEMBL8968929 | 0.82 | HPRT1 (0.68) | HSD17B10ALDH1A1HPGDTSHRCYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110194741-B | 4-benzoyl piperazine-3-nitro-1, 8-naphthalimide derivative and preparation method and application thereof | 桂林医学院 | 2022-09-09 | — | — | CN | disclosed |
| CN-110194740-B | 4-tert-butyloxycarbonylpiperazine-1, 8-naphthalimide derivative and synthetic method and application thereof | 桂林医学院 | 2022-06-17 | — | — | CN | disclosed |
| CN-112472699-A | Combination methods for improving the therapeutic benefit of bisantrene and derivatives | 种族肿瘤学公司 | 2021-03-12 | — | — | CN | disclosed |