Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | THPO | P40225 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.51 |
| ▸ | HK1 | P19367 | 1/20 | 0.47 |
| ▸ | HK2 | P52789 | 1/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | MANBA | O00462 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.43 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| D-Galactose SCHEMBL8977064 | 0.82 | CYP1A2 (0.48) | CYP1A2NFKB1THPOALDH1A1PMP22 | |
| SCHEMBL7082189 | 0.82 | CYP1A2 (0.54) | CYP1A2NFKB1THPOALDH1A1PMP22 | |
| SCHEMBL7082194 | 0.81 | ACHE (0.65) | CYP1A2NFKB1THPOALDH1A1PMP22 | |
| SCHEMBL7082190 | 0.81 | ACHE (0.65) | CYP1A2NFKB1THPOALDH1A1PMP22 | |
| SCHEMBL8956194 | 0.81 | ACHE (0.65) | CYP1A2NFKB1THPOALDH1A1PMP22 | |
| D-Galactose SCHEMBL8955287 | 0.80 | ERN1 (0.62) | CYP1A2NFKB1THPOALDH1A1PMP22 | |
| SCHEMBL31493924 | 0.79 | HTT (0.66) | ALDH1A1GAAHTTPKMKCNMA1 | |
| SCHEMBL221924 | 0.79 | HTT (0.66) | ALDH1A1GAAHTTPKMKCNMA1 | |
| B-D-Galactose SCHEMBL28293001 | 0.79 | ALDH1A1 (0.61) | CYP1A2NFKB1ALDH1A1DYRK1AKDM4E | |
| D-Galactose SCHEMBL769918 | 0.79 | HK1 (0.50) | CYP1A2NFKB1THPOALDH1A1PMP22 |
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 |
|---|---|---|---|---|---|---|---|
| US-5514560-A | GALACTOPYRANOSIDE DERIVATIVES | BOEHRINGER MANNHEIM CORPORATION (US) | 1996-05-07 | — | — | US | disclosed |
| US-5444161-A | Meta-Cyano-para-nitrophenyl-beta-D-galactopyranoside | MICROGENICS CORPORATION (US) | 1995-08-22 | — | — | US | disclosed |