Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.57 |
| ▸ | HTR2A | P28223 | 3/20 | 0.56 |
| ▸ | HTR2C | P28335 | 3/20 | 0.56 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | GPR3 | P46089 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL28906383 | 0.83 | KIF11 (0.54) | ESR1ESR2HTR2AHTR2CNPSR1 | |
| SCHEMBL28906378 | 0.81 | TUBB4A (0.53) | HTR2AHTR2CDRD2ALDH1A1PTGS2 | |
| SCHEMBL28906355 | 0.81 | PTGS2 (0.53) | HTR2AHTR2CALDH1A1PTGS2KDM4E | |
| SCHEMBL28906386 | 0.81 | HTR6 (0.60) | ESR1ESR2HTR2AHTR2CDRD2 | |
| SCHEMBL1260425 | 0.75 | CYP11B1 (0.66) | ESR1ESR2HTR2AHTR2CDRD2 | |
| SCHEMBL11495830 | 0.74 | HTR2A (0.71) | ESR1ESR2HTR2AHTR2CDRD2 | |
| SCHEMBL18787054 | 0.74 | ESR1 (0.87) | ESR1ESR2HTR2AHTR2CCYP19A1 | |
| SCHEMBL4066208 | 0.73 | ALDH1A1 (0.58) | HTR2AHTR2CALDH1A1 | |
| SCHEMBL3929385 | 0.72 | ESR1 (0.63) | ESR1ESR2HTR2AHTR2CCYP19A1 | |
| SCHEMBL3864662 | 0.72 | ESR1 (1.00) | ESR1ESR2HTR2AHTR2CCYP19A1 |
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-115304533-A | Bis-indole methane type alpha-glucosidase inhibitor and preparation method and application thereof | 中国医学科学院药用植物研究所云南分所 | 2022-11-08 | — | — | CN | disclosed |