Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | PNMT | P11086 | 4/20 | 0.34 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.34 |
| ▸ | CMA1 | P23946 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | METAP1 | P53582 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TDP2 | O95551 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 3/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.30 |
| ▸ | ROS1 | P08922 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7795105 | 0.83 | PNMT (0.34) | TRPA1PNMTASIC3METAP1ADRA2A | |
| SCHEMBL387117 | 0.74 | ADRA2A (0.35) | ADRA2APARP1PARP10KDM1AHTR2A | |
| SCHEMBL385687 | 0.74 | METAP1 (0.36) | TRPA1METAP1TDP1PARP1PARP10 | |
| SCHEMBL1807611 | 0.68 | PNMT (0.37) | TRPA1PNMTASIC3CMA1AHR | |
| SCHEMBL386103 | 0.67 | PNMT (0.42) | PNMTADRA2AADRA2BADRA2CTDP1 | |
| SCHEMBL206261 | 0.65 | MAPT (0.40) | TRPA1AHRHTR2C | |
| SCHEMBL8343541 | 0.65 | TRPA1 (0.34) | TRPA1PARP1 | |
| SCHEMBL20528826 | 0.65 | TRPA1 (0.34) | TRPA1PARP1 | |
| SCHEMBL20101466 | 0.65 | PNMT (0.42) | PNMTASIC3CMA1AHRMETAP1 | |
| SCHEMBL9413877 | 0.64 | — | — |
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-1155698-A1 | ORGANOBORON COMPOUNDS EXHIBITING ANTICOCCIDIAL ACTIVITIES | Nitto Kasei Co., Ltd. (JP) | 2001-11-21 | — | — | EP | disclosed |