Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 12/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.56 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | PDE4A | P27815 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL22521931 | 0.97 | TNF (0.60) | TNFMAPK1RXFP1ADORA2BLMNA | |
| SCHEMBL24559132 | 0.92 | TNF (0.59) | TNFMAPK1RXFP1ADORA2BLMNA | |
| SCHEMBL11321532 | 0.85 | TNF (0.66) | TNFMAPK1RXFP1ADORA2BLMNA | |
| SCHEMBL24559262 | 0.82 | RXFP1 (0.50) | TNFMAPK1RXFP1ADORA2BLMNA | |
| SCHEMBL24559323 | 0.81 | RXFP1 (0.70) | TNFMAPK1RXFP1ADORA2BLMNA | |
| SCHEMBL24559134 | 0.81 | RXFP1 (0.56) | MAPK1RXFP1ADORA2BLMNAESR1 | |
| SCHEMBL17626126 | 0.80 | ADORA2B (0.65) | TNFMAPK1RXFP1ADORA2BLMNA | |
| SCHEMBL17682215 | 0.79 | TNF (0.77) | TNFMAPK1RXFP1ADORA2BLMNA | |
| SCHEMBL24559298 | 0.79 | ADORA2B (0.61) | MAPK1RXFP1ADORA2BLMNAMAPT | |
| SCHEMBL17682325 | 0.79 | TNF (0.80) | TNFMAPK1RXFP1ADORA2BLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020205646-A2 | SMALL MOLECULE PARG INHIBITORS AND METHODS OF USE THEREOF | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2020-10-08 | — | — | WO | disclosed |