Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.52 |
| ▸ | GPR17 | Q13304 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 3/20 | 0.46 |
| ▸ | KMO | O15229 | 1/20 | 0.43 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.42 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | PDE9A | O76083 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18509730 | 0.89 | PLA2G4A (0.47) | EGLN1GPR17EGFRPLA2G4AMAPT | |
| SCHEMBL18509483 | 0.86 | EGFR (0.49) | EGFRKMOPLA2G4ATHRATHRB | |
| SCHEMBL19872728 | 0.84 | KDM4E (0.50) | EGLN1EGFRPLA2G4ATHRATHRB | |
| SCHEMBL19872619 | 0.83 | MCL1 (0.55) | GPR17EGFRKMOAKR1C3AKR1C2 | |
| SCHEMBL19872669 | 0.83 | AKR1C3 (0.53) | GPR17EGFRPLA2G4ATHRATHRB | |
| SCHEMBL19872667 | 0.82 | EGFR (0.48) | EGFRPLA2G4ATHRATHRBAKR1C3 | |
| SCHEMBL25492622 | 0.82 | EGLN1 (0.53) | EGLN1GPR17KMOPLA2G4AMAPT | |
| SCHEMBL20119990 | 0.81 | PTGS1 (0.55) | GPR17KMOAKR1C3AKR1C2KDM4E | |
| SCHEMBL18509737 | 0.81 | RXRA (0.54) | GPR17EGFRPLA2G4ATHRATHRB | |
| SCHEMBL21392039 | 0.80 | FABP4 (0.45) | EGFRPLA2G4ATHRATHRBAKR1C3 |
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-2018081456-A1 | HIGHLY ACTIVE SELF-SUFFICIENT NITRATION BIOCATALYSTS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) | 2018-05-03 | — | — | WO | disclosed |