Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 6/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | UCHL1 | P09936 | 2/20 | 0.37 |
| ▸ | MC4R | P32245 | 1/20 | 0.37 |
| ▸ | MC5R | P33032 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.36 |
| ▸ | HRH2 | P25021 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | BUB1 | O43683 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28978028 | 0.88 | MAPK1 (0.43) | PARP1GPR119NPC1MAPK1UCHL1 | |
| SCHEMBL30740797 | 0.85 | PARP1 (0.38) | PARP1NPC1MAPK1UCHL1MC4R | |
| SCHEMBL28067177 | 0.84 | GPR119 (0.47) | PARP1GPR119NPC1UCHL1MC4R | |
| SCHEMBL441130 | 0.81 | NPC1 (0.51) | GPR119NPC1UCHL1HRH2HRH1 | |
| SCHEMBL26115692 | 0.81 | PARP1 (0.43) | PARP1GPR119MAPK1USP30 | |
| SCHEMBL29072017 | 0.80 | PARP1 (0.39) | PARP1GPR119NPC1MAPK1UCHL1 | |
| SCHEMBL1115469 | 0.79 | LMNA (0.41) | PARP1GPR119NPC1UCHL1MC4R | |
| SCHEMBL4315846 | 0.78 | PARP1 (0.55) | PARP1GPR119 | |
| SCHEMBL2480988 | 0.76 | HSD17B10 (0.47) | PARP1NPC1MAPK1MC4RMC5R | |
| SCHEMBL18673224 | 0.76 | PARP1 (0.44) | PARP1NPC1MAPK1MC4RMC5R |
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-2016034134-A1 | HETEROAROMATIC DERIVATIVES AND PHARMACEUTICAL APPLICATIONS THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-03-10 | — | — | WO | disclosed |