Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | UBE2N | P61088 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1205950 | 0.82 | HTR2A (0.48) | TRPA1SLC6A2SLC6A4SLC6A3ADRA2B | |
| SCHEMBL1205954 | 0.82 | HTR2A (0.48) | TRPA1SLC6A2SLC6A4SLC6A3ADRA2B | |
| SCHEMBL6492940 | 0.81 | KDM4E (0.49) | KDM4EL3MBTL1SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL17509983 | 0.81 | SLC6A2 (0.50) | TRPA1SLC6A2SLC6A4SLC6A3ADRA2B | |
| SCHEMBL11504772 | 0.81 | KDM4E (0.45) | KDM4EL3MBTL1SLC6A2SLC6A4RXFP1 | |
| SCHEMBL11741694 | 0.79 | KDM4E (0.44) | KDM4EL3MBTL1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8857146 | 0.79 | SLC6A2 (0.49) | KDM4EL3MBTL1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11677887 | 0.79 | TSHR (0.55) | L3MBTL1TRPA1TSHRPOLB | |
| SCHEMBL8852755 | 0.78 | KDM4E (0.44) | KDM4EL3MBTL1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11701688 | 0.78 | AOC3 (0.44) | KDM4EL3MBTL1SLC6A2SLC6A4RXFP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4051117-A | Triazole-azo-phenyl cationic dyestuffs | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-27 | — | — | US | disclosed |
| US-4051084-A | BENZOTHIAZOLE | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-27 | — | — | US | disclosed |