Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.40 |
| ▸ | NAMPT | P43490 | 3/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MAP2K4 | P45985 | 2/20 | 0.36 |
| ▸ | PARP1 | P09874 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | MAPK6 | Q16659 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.35 |
| ▸ | TNKS | O95271 | 3/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.35 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8551845 | 0.89 | ROCK2 (0.48) | ALDH1A1SMN1; SMN2ATMNPSR1ROCK2 | |
| SCHEMBL8551517 | 0.78 | NPSR1 (0.57) | ALDH1A1SMN1; SMN2ATMNPSR1ROCK2 | |
| SCHEMBL8552572 | 0.78 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2ATMNPSR1ROCK2 | |
| SCHEMBL8551547 | 0.78 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2ATMNPSR1ROCK2 | |
| SCHEMBL8548542 | 0.77 | ROCK2 (0.47) | ALDH1A1SMN1; SMN2ATMNPSR1ROCK2 | |
| SCHEMBL7884963 | 0.74 | ATM (0.73) | ALDH1A1SMN1; SMN2ATMNPSR1ROCK2 | |
| SCHEMBL30602968 | 0.73 | PIK3CA (0.46) | ATMNPSR1ROCK2NAMPTMAPT | |
| SCHEMBL26615156 | 0.73 | PIK3CA (0.46) | ATMNPSR1ROCK2NAMPTMAPT | |
| SCHEMBL9226004 | 0.72 | ATM (0.49) | ALDH1A1SMN1; SMN2ATMNPSR1ROCK2 | |
| SCHEMBL1407266 | 0.72 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2ROCK2NAMPTGRM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0825187-A1 | Condensed pyridazinyl guanidines, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-02-25 | — | — | EP | disclosed |