Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16938329 | 0.83 | ALDH1A1 (0.39) | HRH1ALDH1A1CYP1A2TSHRRAB9A | |
| SCHEMBL23716291 | 0.83 | ALDH1A1 (0.39) | HRH1ALDH1A1CYP1A2TSHRRAB9A | |
| SCHEMBL28632625 | 0.79 | ALDH1A1 (0.46) | HRH1ALDH1A1CYP1A2TSHRGRIN2D | |
| SCHEMBL12320656 | 0.73 | HRH1 (0.40) | HRH1ALDH1A1GRIN2DGRIN3BGRIN1 | |
| SCHEMBL2093319 | 0.73 | ALDH1A1 (0.50) | HRH1ALDH1A1CYP1A2TSHRRAB9A | |
| SCHEMBL1970184 | 0.70 | HRH1 (0.47) | HRH1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL8373918 | 0.70 | HRH1 (0.47) | HRH1GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL29828134 | 0.70 | ALDH1A1 (0.61) | ALDH1A1CYP1A2TSHRRAB9ANPC1 | |
| SCHEMBL211090 | 0.70 | ALDH1A1 (0.61) | ALDH1A1CYP1A2TSHRRAB9ANPC1 | |
| SCHEMBL13006160 | 0.70 | ALDH1A1 (0.47) | HRH1ALDH1A1CYP1A2TSHRRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021222522-A1 | CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2021-11-04 | — | — | WO | disclosed |