Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1022607 | 0.87 | SMN1; SMN2 (0.57) | KEAP1NFE2L2TSHRCASP1SMN1; SMN2 | |
| SCHEMBL29566 | 0.84 | KEAP1 (0.47) | KEAP1NFE2L2TSHRCASP1SMN1; SMN2 | |
| SCHEMBL6498251 | 0.81 | ALDH1A1 (0.48) | TSHRCASP1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL16041940 | 0.80 | KEAP1 (0.54) | KEAP1NFE2L2TSHRCASP1SMN1; SMN2 | |
| SCHEMBL2578143 | 0.79 | CXCL8 (0.57) | KEAP1NFE2L2TSHRCASP1SMN1; SMN2 | |
| SCHEMBL29497752 | 0.79 | CXCL8 (0.57) | KEAP1NFE2L2TSHRCASP1SMN1; SMN2 | |
| SCHEMBL868684 | 0.77 | KEAP1 (0.51) | KEAP1NFE2L2SMN1; SMN2CXCL8CYP2C9 | |
| SCHEMBL3141863 | 0.77 | HIF1A (0.61) | KEAP1NFE2L2TSHRCASP1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL1373062 | 0.77 | CXCL8 (0.55) | KEAP1NFE2L2TSHRCASP1SMN1; SMN2 | |
| SCHEMBL27431215 | 0.76 | MAPT (0.43) | TSHRCASP1SMN1; SMN2MAPTKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101948444-A | synthesized small molecular compound capable for transferring bioactive substances and applications thereof | DONGXIA XING | 2011-01-19 | — | — | CN | disclosed |
| CN-101555212-A | Synthetic small molecule compound capable of conveying bioactive substances and application thereof | DONGXIA XING (CN) | 2009-10-14 | — | — | CN | disclosed |