Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 10/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.45 |
| ▸ | MEN1 | O00255 | 6/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.45 |
| ▸ | ATM | Q13315 | 4/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11301165 | 0.69 | NPC1 (0.51) | MAPTNPSR1SMN1; SMN2KMT2ANPC1 | |
| SCHEMBL12254378 | 0.69 | MAPK1 (0.49) | MAPTNPSR1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL9203100 | 0.68 | NPC1 (0.46) | MAPTNPSR1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL14373076 | 0.68 | GSK3B (0.42) | MAPTKMT2AMEN1HTTALDH1A1 | |
| SCHEMBL9668731 | 0.68 | MAPT (0.52) | MAPTNPSR1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL2352818 | 0.67 | MAPT (0.52) | MAPTNPSR1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL10417595 | 0.64 | MEN1 (0.68) | MAPTNPSR1KMT2AMEN1L3MBTL1 | |
| SCHEMBL19052016 | 0.63 | MAPT (0.47) | MAPTNPSR1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL11542018 | 0.63 | MAPT (0.47) | MAPTNPSR1SMN1; SMN2KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL7772081 | 0.63 | MAPT (0.47) | MAPTNPSR1SMN1; SMN2KMT2AMEN1 |
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-108822089-A | 2- Aryimidazole alkyl compound, preparation method and its application as Hsp90 inhibitor on antitumor | 大连理工大学 | 2018-11-16 | — | — | CN | disclosed |