Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.32 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Boric Acid SCHEMBL28309975 | 0.82 | HTR3E (0.41) | ALDH1A1L3MBTL1DRD2HTR6KDM4E | |
| Boric Acid SCHEMBL28110899 | 0.72 | HTR3A (0.42) | L3MBTL1 | |
| Boric Acid SCHEMBL28328150 | 0.66 | HPGD (0.56) | KMT2APOLBHPGDTSHR | |
| SCHEMBL29538136 | 0.65 | BACE1 (0.38) | GAAALDH1A1L3MBTL1DRD2DRD3 | |
| SCHEMBL21484379 | 0.65 | BACE1 (0.38) | GAAALDH1A1L3MBTL1DRD2DRD3 | |
| SCHEMBL28510117 | 0.64 | ALDH1A1 (0.41) | GAAALDH1A1L3MBTL1DRD2DRD3 | |
| SCHEMBL28258169 | 0.64 | SLC6A4 (0.38) | ALDH1A1DRD2HTR6APOBEC3AAPOBEC3G | |
| SCHEMBL8360744 | 0.64 | DRD2 (0.62) | ALDH1A1DRD2DRD3KMT2AKDM4E | |
| SCHEMBL29157980 | 0.64 | KDM4E (0.46) | ALDH1A1L3MBTL1APOBEC3AAPOBEC3GKDM4E | |
| Boric Acid SCHEMBL27921296 | 0.63 | ALDH1A1 (0.53) | GAAALDH1A1L3MBTL1KMT2AKDM4E |
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-110072865-A | Pyrrolo- heteroaromatic class compound and preparation method thereof and medical usage | 中国医药研究开发中心有限公司 | 2019-07-30 | — | — | CN | disclosed |