Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HNF4A | P41235 | 2/20 | 0.55 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.55 |
| ▸ | CDC25B | P30305 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | KMO | O15229 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | EGFR | P00533 | 1/20 | 0.53 |
| ▸ | DCLRE1A | Q6PJP8 | 1/20 | 0.53 |
| ▸ | DCLRE1B | Q9H816 | 1/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.51 |
| ▸ | DHFR | P00374 | 1/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.50 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.50 |
| ▸ | DDT | P30046 | 1/20 | 0.50 |
| ▸ | TTR | P02766 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.49 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.49 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.49 |
| ▸ | PTPRC | P08575 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL27662171 | 1.00 | HNF4A (0.55) | HNF4AACMSDCDC25BATMKMO | |
| SCHEMBL70541 | 0.96 | KDM4E (0.56) | HNF4AACMSDCDC25BATMKMO | |
| Hydrochloric Acid SCHEMBL28890344 | 0.94 | KDM4E (0.55) | HNF4AACMSDCDC25BATMKMO | |
| Terephthalic Acid SCHEMBL28437947 | 0.94 | KDM4E (0.55) | HNF4ACDC25BATMKMOKDM4E | |
| SCHEMBL6225855 | 0.92 | KDM4E (0.50) | KDM4EPTPN1DDTTTRPTPRC | |
| SCHEMBL460360 | 0.91 | ACMSD (0.58) | HNF4AACMSDCDC25BATMKMO | |
| SCHEMBL599317 | 0.90 | FOLH1 (0.53) | KDM4EDDTTTRPTPRC | |
| SCHEMBL27827385 | 0.89 | KMO (0.65) | HNF4AACMSDCDC25BATMKMO | |
| SCHEMBL9435927 | 0.87 | PTPRC (0.56) | HNF4AACMSDCDC25BATMKMO | |
| SCHEMBL251150 | 0.87 | PTPRC (0.56) | HNF4AACMSDCDC25BATMKMO |
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-118085486-A | Type II porous liquid containing high-concentration coordination cage and preparation method and application thereof | 南京工业大学 | 2024-05-28 | — | — | CN | claimed |
| CN-118085486-A | Type II porous liquid containing high-concentration coordination cage and preparation method and application thereof | 南京工业大学 | 2024-05-28 | — | — | CN | disclosed |
| CN-117683241-A | Deodorant for living environment, preparation method and application thereof, and deodorizing sheet | 浙江金海高科股份有限公司 | 2024-03-12 | — | — | CN | disclosed |