Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.49 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.48 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.48 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.48 |
| ▸ | CKS1B | P61024 | 2/20 | 0.48 |
| ▸ | SKP1 | P63208 | 2/20 | 0.48 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MC4R | P32245 | 1/20 | 0.48 |
| ▸ | NAMPT | P43490 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8567337 | 1.00 | GPR119 (0.49) | GPR119SMARCA2SMARCA4PBRM1CKS1B | |
| SCHEMBL18878434 | 0.90 | GPR119 (0.50) | GPR119SMARCA2SMARCA4PBRM1CKS1B | |
| SCHEMBL8561486 | 0.88 | SMARCA2 (0.50) | GPR119SMARCA2SMARCA4PBRM1CKS1B | |
| SCHEMBL22605981 | 0.88 | GPR119 (0.48) | GPR119SMARCA2SMARCA4PBRM1CKS1B | |
| SCHEMBL8561483 | 0.88 | SMARCA2 (0.50) | GPR119SMARCA2SMARCA4PBRM1CKS1B | |
| SCHEMBL27513839 | 0.85 | SMARCA2 (0.47) | GPR119SMARCA2SMARCA4PBRM1CKS1B | |
| SCHEMBL27565554 | 0.85 | GPR119 (0.45) | GPR119SMARCA2SMARCA4PBRM1CKS1B | |
| SCHEMBL3436307 | 0.83 | AKR1C3 (0.57) | GPR119SMARCA2SMARCA4PBRM1CKS1B | |
| SCHEMBL9056571 | 0.82 | NAMPT (0.44) | GPR119SMARCA2SMARCA4PBRM1CKS1B | |
| SCHEMBL9056581 | 0.82 | NAMPT (0.44) | GPR119SMARCA2SMARCA4PBRM1CKS1B |
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-1996010568-A1 | SUBSTITUTED ARYL PIPERAZINES AS NEUROKININ ANTAGONISTS | MERCK & CO., INC. (US) | 1996-04-11 | — | — | WO | disclosed |