Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 3/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.34 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CMA1 | P23946 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16722791 | 1.00 | PNMT (0.42) | PNMTADRA2AADRA2BADRA2CHTR2A | |
| SCHEMBL30570974 | 0.79 | CYP1A2 (0.38) | HTR2AHTR2CHTR2BNPC1RAB9A | |
| SCHEMBL29070709 | 0.79 | CYP1A2 (0.38) | HTR2AHTR2CHTR2BNPC1RAB9A | |
| SCHEMBL29004257 | 0.79 | HTR2C (0.33) | HTR2AHTR2CHTR2BNPC1LMNA | |
| SCHEMBL29004258 | 0.79 | HTR2C (0.33) | HTR2AHTR2CHTR2BNPC1LMNA | |
| SCHEMBL12077604 | 0.78 | NPC1 (0.47) | PNMTADRA2AADRA2BADRA2CHTR2A | |
| SCHEMBL12077602 | 0.78 | NPC1 (0.47) | PNMTADRA2AADRA2BADRA2CHTR2A | |
| SCHEMBL15508323 | 0.78 | HTR2C (0.40) | ADRA2AADRA2BADRA2CHTR2AHTR2C | |
| SCHEMBL16722790 | 0.78 | BRD4 (0.33) | MAPKAPK2BRD4 | |
| SCHEMBL29004248 | 0.78 | HTR2C (0.40) | ADRA2AADRA2BADRA2CHTR2AHTR2C |
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-2022073469-A1 | COMPOUNDS AND METHODS OF TREATING CANCERS | CULLGEN (SHANGHAI) , INC. (CN) | 2022-04-14 | — | — | WO | disclosed |