Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.55 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.55 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 7/20 | 0.50 |
| ▸ | RAB9A | P51151 | 7/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.48 |
| ▸ | RELA | Q04206 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28226308 | 0.88 | LRRK2 (0.60) | LRRK2MAPTMEN1KMT2AKDM4E | |
| SCHEMBL28227108 | 0.83 | CASP3 (0.62) | LRRK2MAPTMEN1KMT2ANPC1 | |
| SCHEMBL28227094 | 0.80 | HTT (0.56) | LRRK2MAPTMEN1KMT2AKDM4E | |
| SCHEMBL28227101 | 0.79 | DYRK1A (0.62) | LRRK2MAPTMEN1KMT2AKDM4E | |
| SCHEMBL28227104 | 0.78 | RAB9A (0.71) | MAPTMEN1KMT2AKDM4ENPC1 | |
| SCHEMBL28226343 | 0.78 | DYRK1A (0.57) | MEN1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28227100 | 0.77 | KDM4E (0.56) | LRRK2MAPTMEN1KMT2AKDM4E | |
| SCHEMBL28860940 | 0.77 | HSD17B10 (0.56) | MAPTMEN1KMT2AKDM4ELMNA | |
| SCHEMBL28226394 | 0.77 | LRRK2 (0.53) | LRRK2MAPTMEN1KMT2AKDM4E | |
| SCHEMBL28226337 | 0.76 | NPC1 (0.58) | HSD17B1HSD17B2LRRK2MEN1KMT2A |
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-105175408-B | Benzothiazole compound and its purposes as drug | 中国人民解放军第二军医大学 | 2018-07-17 | — | — | CN | disclosed |