Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | ATP6V1B2 | P21281 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | EDNRA | P25101 | 1/20 | 0.37 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.37 |
| ▸ | TOP2A | P11388 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.34 |
| ▸ | CASP1 | P29466 | 4/20 | 0.34 |
| ▸ | CASP7 | P55210 | 4/20 | 0.34 |
| ▸ | USP2 | O75604 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22774069 | 0.78 | PDE4A (0.34) | LMNAALDH1A1HPGDKDM4E | |
| SCHEMBL29353417 | 0.78 | LMNA (0.46) | CYP2C9LMNAATP6V1B2TBXA2REDNRA | |
| SCHEMBL28678768 | 0.78 | LMNA (0.46) | CYP2C9LMNAATP6V1B2TBXA2REDNRA | |
| SCHEMBL28296390 | 0.78 | HRH4 (0.38) | CYP2C9LMNAATP6V1B2TBXA2REDNRA | |
| SCHEMBL29724074 | 0.78 | TOP2A (0.50) | CYP2C9LMNATOP2AALDH1A1CYP1A2 | |
| SCHEMBL28776450 | 0.78 | TOP2A (0.50) | CYP2C9LMNATOP2AALDH1A1CYP1A2 | |
| SCHEMBL29577112 | 0.68 | PDE4A (0.33) | TOP2A | |
| SCHEMBL8486770 | 0.68 | PDE4A (0.33) | TOP2A | |
| SCHEMBL28110887 | 0.68 | MAPT (0.45) | CYP2C9ALDH1A1CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL2421661 | 0.67 | HRH4 (0.45) | CYP2C9LMNAATP6V1B2TBXA2REDNRA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109776411-B | Nitrogen mustard carbostyril derivative and preparation method and application thereof | 石家庄学院 | 2022-06-07 | — | — | CN | disclosed |