Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | GRM5 | P41594 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CKS1B | P61024 | 2/20 | 0.47 |
| ▸ | SKP1 | P63208 | 2/20 | 0.47 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.45 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.45 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | DTYMK | P23919 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| 2-Aminopyridine SCHEMBL28404259 | 0.87 | GPR119 (0.53) | GPR119POLBGRM5CKS1BSKP1 | |
| SCHEMBL28585097 | 0.85 | GPR119 (0.53) | GPR119POLBGRM5HPGDCKS1B | |
| 2-Aminopyridine SCHEMBL28568460 | 0.81 | TLR8 (0.50) | GPR119POLBCKS1BSKP1SKP2 | |
| SCHEMBL29461540 | 0.79 | GPR119 (0.76) | GPR119POLBGRM5HPGDCKS1B | |
| SCHEMBL30793467 | 0.78 | GPR119 (0.51) | GPR119POLBGRM5CKS1BSKP1 | |
| 2-Aminopyridine SCHEMBL28684762 | 0.77 | NOS3 (0.53) | GPR119POLBGRM5HPGDMEN1 | |
| SCHEMBL29461612 | 0.77 | GPR119 (0.72) | GPR119POLBCKS1BSKP1SKP2 | |
| SCHEMBL4823523 | 0.77 | GPR119 (0.72) | GPR119POLBCKS1BSKP1SKP2 | |
| SCHEMBL29086062 | 0.77 | GPR119 (0.53) | GPR119POLBGRM5HPGDCKS1B | |
| SCHEMBL19864899 | 0.76 | HPGD (0.71) | POLBHPGDMEN1KMT2AABL1 |
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-111333627-A | Substituted 2-hydro-pyrazole derivatives as anti-cancer agents | 正大天晴药业集团股份有限公司 | 2020-06-26 | — | — | CN | disclosed |