Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.46 |
| ▸ | ELANE | P08246 | 3/20 | 0.39 |
| ▸ | PDE2A | O00408 | 2/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.39 |
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL537851 | 0.86 | PARP1 (0.46) | PARP1ELANEPDE2APDE10AACHE | |
| SCHEMBL4787075 | 0.79 | PARP1 (0.46) | PARP1ELANEPDE2APDE10APBRM1 | |
| SCHEMBL538143 | 0.76 | PARP1 (0.42) | PARP1ELANEPBRM1GRIN1GRIN2A | |
| SCHEMBL27810585 | 0.74 | GPR3 (0.53) | PDE10A | |
| SCHEMBL28311772 | 0.73 | GPR3 (0.57) | PARP1ELANEPDE2APDE10APBRM1 | |
| SCHEMBL12501261 | 0.72 | PARP1 (0.50) | PARP1ELANEPBRM1DHODHGRIN1 | |
| SCHEMBL29008939 | 0.71 | PARP1 (0.46) | PARP1ELANEPBRM1DHODHGRIN1 | |
| SCHEMBL4748400 | 0.69 | MAPT (0.52) | PARP1ELANEPBRM1DHODHGRIN1 | |
| SCHEMBL12501259 | 0.69 | PARP1 (0.47) | PARP1ELANEPBRM1DHODHGRIN1 | |
| SCHEMBL7417855 | 0.68 | PARP1 (0.50) | PARP1ELANEPBRM1DHODHGRIN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108137547-A | It can be used as the heterocyclic compound of TNF α conditioning agent | 百时美施贵宝公司 | 2018-06-08 | — | — | CN | disclosed |