Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 7/20 | 0.67 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.67 |
| ▸ | CHRNB4 | P30926 | 6/20 | 0.67 |
| ▸ | CHRNA3 | P32297 | 6/20 | 0.67 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.67 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.67 |
| ▸ | CHRNA1 | P02708 | 4/20 | 0.67 |
| ▸ | CHRNG | P07510 | 4/20 | 0.67 |
| ▸ | CHRNB1 | P11230 | 4/20 | 0.67 |
| ▸ | CHRND | Q07001 | 4/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.65 |
| ▸ | GAA | P10253 | 1/20 | 0.65 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL11037118 | 1.00 | SLC6A2 (0.67) | SLC6A2SLC6A3CHRNB4CHRNA3CHRNB2 | |
| Hydrochloric Acid SCHEMBL28057449 | 0.98 | SLC6A2 (0.65) | SLC6A2SLC6A3CHRNB4CHRNA3CHRNB2 | |
| SCHEMBL1072701 | 0.98 | SLC6A2 (0.69) | SLC6A2SLC6A3CHRNB4CHRNA3CHRNB2 | |
| Hydrochloric Acid SCHEMBL22614730 | 0.98 | SLC6A2 (0.65) | SLC6A2SLC6A3CHRNB4CHRNA3CHRNB2 | |
| Bromide SCHEMBL13729160 | 0.96 | SLC6A2 (0.68) | SLC6A2SLC6A3CHRNB4CHRNA3CHRNB2 | |
| Hydrochloric Acid SCHEMBL10728832 | 0.96 | SLC6A2 (0.68) | SLC6A2SLC6A3CHRNB4CHRNA3CHRNB2 | |
| SCHEMBL1714913 | 0.84 | SLC6A2 (0.50) | SLC6A2SLC6A3CHRNB4CHRNA3CHRNB2 | |
| SCHEMBL4869220 | 0.84 | OPRD1 (0.53) | SLC6A2SLC6A3CHRNB4CHRNA3CHRNB2 | |
| SCHEMBL4818799 | 0.84 | CYP2D6 (0.67) | SLC6A2SLC6A3CHRNB4CHRNA3CHRNB2 | |
| SCHEMBL321368 | 0.84 | ALDH1A1 (0.67) | SLC6A2SLC6A3CHRNB4CHRNA3CHRNB2 |
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-110655496-A | Method for synthesizing chiral compound | 安徽贝克联合制药有限公司 | 2020-01-07 | — | — | CN | disclosed |