Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21524670 | 0.87 | PARP1 (0.38) | PDE10APARP1TP53RXFP1PDE5A | |
| SCHEMBL145199 | 0.84 | BRD4 (0.47) | PARP1TP53RXFP1BRD4MAPT | |
| SCHEMBL30434436 | 0.84 | BRD4 (0.47) | PARP1TP53RXFP1BRD4MAPT | |
| SCHEMBL30434906 | 0.82 | PIK3CD (0.39) | PDE10APARP1TP53RXFP1ALDH1A1 | |
| SCHEMBL30434568 | 0.81 | BRD4 (0.54) | PARP1BRD4 | |
| SCHEMBL121706 | 0.81 | BRD4 (0.54) | PARP1BRD4 | |
| Hydrochloric Acid SCHEMBL30434224 | 0.80 | BRD4 (0.53) | PARP1BRD4 | |
| Hydrochloric Acid SCHEMBL148595 | 0.80 | BRD4 (0.53) | PARP1BRD4 | |
| SCHEMBL349746 | 0.75 | TP53 (0.40) | PDE10APARP1TP53RXFP1PDE5A | |
| SCHEMBL15302118 | 0.71 | KDM1A (0.53) | MAPK1SRCLMNA |
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-2017041701-A1 | NITRIC OXIDE-RELEASING PRODRUG MOLECULE | 浙江华海药业股份有限公司 | 2017-03-16 | — | — | WO | disclosed |