Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.46 |
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.46 |
| ▸ | PDE2A | O00408 | 3/20 | 0.46 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.46 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.46 |
| ▸ | TLR9 | Q9NR96 | 5/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16815230 | 0.95 | PDE2A (0.49) | TLR7PDE2APDE3BPDE3AP2RY12 | |
| Betaine SCHEMBL16817835 | 0.90 | TLR7 (0.43) | MAPTTLR7PDE2APDE3BPDE3A | |
| SCHEMBL16848747 | 0.88 | TLR9 (0.44) | MAPTTLR7PDE2APDE3BPDE3A | |
| SCHEMBL16815239 | 0.87 | HDAC6 (0.48) | MAPTF2RL3TLR7KDM4EALDH1A1 | |
| SCHEMBL20057418 | 0.87 | TLR9 (0.43) | MAPTTLR7PDE2APDE3BPDE3A | |
| Bromide SCHEMBL16817759 | 0.86 | HDAC6 (0.47) | MAPTF2RL3KDM4EALDH1A1 | |
| SCHEMBL16815297 | 0.86 | TLR9 (0.43) | TLR7PDE2APDE3BPDE3AP2RY12 | |
| Glycinebetaine SCHEMBL16817774 | 0.81 | TLR7 (0.38) | MAPTTLR7PDE2APDE3BPDE3A | |
| SCHEMBL16815204 | 0.81 | ESR2 (0.54) | ESR1ESR2 | |
| SCHEMBL16848768 | 0.79 | TLR9 (0.45) | F2RL3TLR7PDE2APDE3BPDE3A |
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-2886542-B1 | Marker dyes for UV and short-wave excitation with high Stokes shift on the basis of benzoxazoles | DYOMICS GMBH (DE) | 2018-04-18 | — | — | EP | disclosed |