Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.46 |
| ▸ | CA1 | P00915 | 6/20 | 0.46 |
| ▸ | CA12 | O43570 | 4/20 | 0.46 |
| ▸ | CA9 | Q16790 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | LGALS1 | P09382 | 2/20 | 0.32 |
| ▸ | LGALS3 | P17931 | 2/20 | 0.32 |
| ▸ | LGALS9 | O00182 | 1/20 | 0.32 |
| ▸ | LGALS8 | O00214 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7148945 | 1.00 | CA2 (0.46) | CA2CA1CA12CA9CYP3A4 | |
| SCHEMBL12563499 | 1.00 | CA2 (0.46) | CA2CA1CA12CA9CYP3A4 | |
| SCHEMBL1686164 | 1.00 | CA2 (0.46) | CA2CA1CA12CA9CYP3A4 | |
| SCHEMBL18536440 | 0.76 | CA2 (0.43) | CA2CA1CA12CA9CYP3A4 | |
| SCHEMBL13275751 | 0.76 | ALDH1A1 (0.44) | CA2CA1CA12CA9CYP3A4 | |
| SCHEMBL24797484 | 0.72 | CYP2C19 (0.53) | CA2CA1CA12CA9CYP3A4 | |
| SCHEMBL13895535 | 0.72 | CA1 (0.41) | CA2CA1CA12CA9CYP3A4 | |
| SCHEMBL21832106 | 0.72 | CYP2C19 (0.53) | CA2CA1CA12CA9CYP3A4 | |
| SCHEMBL10955099 | 0.72 | CA1 (0.41) | CA2CA1CA12CA9CYP3A4 | |
| SCHEMBL9862748 | 0.72 | CA1 (0.41) | CA2CA1CA12CA9CYP3A4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6093805-A | AGLYCON COMPOUNDS HAVING HYDROXY, MERCAPTO, OR CARBOXY GROUP AND LINKED TO MONO- AND DISACCHARIDES HAVING 2,3-DIDEOXY-ALPHA-D-ERYTHRO-HEX-2-ENOPYRANOSIDE MOIETY; BETTER PHARMACOLOGICAL PROPERTIES INCLUDING WATER SOLUBILITY | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2000-07-25 | — | — | US | claimed |
| US-5693767-A | 2,3-DIDEOXY-ALPHA-D-ERYTHRO-HEX-2-ENOPYRANOSIDE DERIVATIVE OF ACETAMINOPHEN; WATER SOLUBILITY | HARRIER INC. (US) | 1997-12-02 | — | — | US | claimed |
| WO-1995032981-A1 | NOVEL GLYCOSIDE COMPOUNDS AND PRODUCTION AND USE THEREOF | HARRIER, INC. (US) | 1995-12-07 | — | — | WO | claimed |
| US-6093805-A | AGLYCON COMPOUNDS HAVING HYDROXY, MERCAPTO, OR CARBOXY GROUP AND LINKED TO MONO- AND DISACCHARIDES HAVING 2,3-DIDEOXY-ALPHA-D-ERYTHRO-HEX-2-ENOPYRANOSIDE MOIETY; BETTER PHARMACOLOGICAL PROPERTIES INCLUDING WATER SOLUBILITY | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2000-07-25 | — | — | US | disclosed |
| US-5693767-A | 2,3-DIDEOXY-ALPHA-D-ERYTHRO-HEX-2-ENOPYRANOSIDE DERIVATIVE OF ACETAMINOPHEN; WATER SOLUBILITY | HARRIER INC. (US) | 1997-12-02 | — | — | US | disclosed |
| WO-1995032981-A1 | NOVEL GLYCOSIDE COMPOUNDS AND PRODUCTION AND USE THEREOF | HARRIER, INC. (US) | 1995-12-07 | — | — | WO | disclosed |