Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 16/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 15/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.41 |
| ▸ | XDH | P47989 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8915404 | 0.81 | ALDH1A1 (0.49) | ADORA1ADORA2AHSD17B10KDM4EALDH1A1 | |
| SCHEMBL8309863 | 0.79 | GAA (0.60) | ADORA1ADORA2AHSD17B10KDM4EALDH1A1 | |
| SCHEMBL8914681 | 0.73 | PLAUR (0.51) | ADORA1ADORA2AHSD17B10KDM4EALDH1A1 | |
| SCHEMBL27847239 | 0.72 | ADORA1 (0.54) | ADORA1ADORA2AHSD17B10XDHKDM4E | |
| SCHEMBL29544234 | 0.72 | ADORA1 (0.48) | ADORA1ADORA2AADORA2BGAA | |
| SCHEMBL18988298 | 0.72 | ADORA1 (0.48) | ADORA1ADORA2AHSD17B10KDM4EALDH1A1 | |
| SCHEMBL18988285 | 0.72 | ADORA1 (0.48) | ADORA1ADORA2AADORA2BGAA | |
| SCHEMBL14833516 | 0.71 | BRAF (0.58) | ADORA1ADORA2AKDM4EALDH1A1MAPT | |
| SCHEMBL17173942 | 0.71 | LMNA (0.56) | ADORA1ADORA2AHSD17B10XDHKDM4E | |
| SCHEMBL4722946 | 0.71 | NPSR1 (0.57) | KDM4EALDH1A1MAPTHTTGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5593997-A | 4-aminopyrazolo(3-,4-D)pyrimidine and 4-aminopyrazolo-(3,4-D)pyridine tyrosine kinase inhibitors | PFIZER INC. (US) | 1997-01-14 | — | — | US | disclosed |