Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CASP1 | P29466 | 2/20 | 0.47 |
| ▸ | CASP7 | P55210 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9946140 | 0.80 | SMN1; SMN2 (0.41) | RAB9ASMN1; SMN2NPC1TDP1ALDH1A1 | |
| SCHEMBL488607 | 0.80 | TSHR (0.46) | RAB9ASMN1; SMN2NPC1CA1CA2 | |
| SCHEMBL21816954 | 0.79 | MAPK1 (0.41) | RAB9ASMN1; SMN2NPC1ALDH1A1GAA | |
| SCHEMBL12027207 | 0.78 | CA12 (0.56) | RAB9ASMN1; SMN2NPC1CA1CA2 | |
| SCHEMBL178972 | 0.77 | NPC1 (0.71) | RAB9ASMN1; SMN2NPC1CA1CA2 | |
| SCHEMBL2360322 | 0.77 | NPC1 (0.71) | RAB9ASMN1; SMN2NPC1CA1CA2 | |
| SCHEMBL16142366 | 0.75 | CA1 (0.61) | RAB9ASMN1; SMN2NPC1CA1CA2 | |
| SCHEMBL6420071 | 0.75 | NPC1 (0.68) | RAB9ASMN1; SMN2NPC1CA1CA2 | |
| SCHEMBL28993944 | 0.74 | CA1 (0.80) | RAB9ANPC1CA1CA2TDP1 | |
| SCHEMBL23600 | 0.74 | CA1 (0.80) | RAB9ANPC1CA1CA2TDP1 |
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-106946796-B | Aminopyrimidine derivatives useful as modulators of kinase activity | 默克专利有限公司 | 2020-05-08 | — | — | CN | disclosed |