Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.45 |
| ▸ | DDR1 | Q08345 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL576501 | 0.77 | AGBL2 (0.39) | DDR1MAPTSLC6A2SLC6A4AGBL2 | |
| SCHEMBL576721 | 0.77 | SLC6A2 (0.45) | DDR1MAPTSLC6A2SLC6A4AGBL2 | |
| SCHEMBL25457334 | 0.76 | DDR1 (0.45) | DDR1MAPTSLC6A2SLC6A4AGBL2 | |
| SCHEMBL6441169 | 0.70 | MAPT (0.39) | MAPTSLC6A2SLC6A4SMN1; SMN2RIPK1 | |
| SCHEMBL13548272 | 0.70 | MAPT (0.39) | MAPTSLC6A2SLC6A4SMN1; SMN2RIPK1 | |
| SCHEMBL8202352 | 0.69 | MAPT (0.38) | MAPTSLC6A4SMN1; SMN2RIPK1PKM | |
| SCHEMBL3667517 | 0.68 | IDO1 (0.40) | MAPTSLC6A4SMN1; SMN2RIPK1PKM | |
| SCHEMBL1776430 | 0.68 | CA2 (0.60) | CA2MAPTPOLB | |
| SCHEMBL16676205 | 0.68 | DDR1 (0.43) | DDR1SLC6A2SLC6A4AGBL2KDM4E | |
| SCHEMBL13557208 | 0.67 | MAPT (0.37) | MAPTSLC6A4AGBL2SMN1; SMN2RIPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3786167-A1 | DIARYL MACROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION, AND USE THEREOF | Primegene (Beijing) Co., Ltd. (CN) | 2021-03-03 | — | — | EP | disclosed |