Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 5/20 | 0.55 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28287681 | 1.00 | HCAR3 (0.55) | HCAR3HCAR2RAB9ANPC1MAPT | |
| SCHEMBL24101021 | 0.84 | HCAR3 (0.67) | HCAR3HCAR2RAB9ANPC1MAPT | |
| SCHEMBL11565569 | 0.82 | SMN1; SMN2 (0.56) | HCAR3RAB9ANPC1MAPTKDM4E | |
| SCHEMBL12380464 | 0.80 | HCAR3 (0.60) | HCAR3RAB9ANPC1MAPTKDM4E | |
| SCHEMBL10398453 | 0.80 | MAPT (0.61) | RAB9ANPC1MAPTKDM4EGAA | |
| SCHEMBL9592348 | 0.80 | HCAR3 (0.70) | HCAR3RAB9ANPC1MAPTKDM4E | |
| SCHEMBL1345024 | 0.80 | HCAR3 (0.54) | HCAR3HCAR2RAB9ANPC1MAPT | |
| SCHEMBL214930 | 0.79 | LMNA (0.51) | HCAR3RAB9ANPC1MAPTKDM4E | |
| SCHEMBL17365710 | 0.78 | HCAR3 (0.71) | HCAR3RAB9ANPC1MAPTKDM4E | |
| SCHEMBL9128629 | 0.78 | HCAR3 (0.49) | HCAR3HCAR2RAB9ANPC1MAPT |
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-109641906-A | HETEROARYL SUBSTITUTED AMINOPYRIDINE COMPOUNDS | 百时美施贵宝公司 | 2019-04-16 | — | — | CN | disclosed |