Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.47 |
| ▸ | NAMPT | P43490 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.39 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.39 |
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 | 0.88 | ROCK2 (0.48) | ROCK2NAMPTALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL8551517 | 0.87 | NPSR1 (0.57) | ROCK2NAMPTALDH1A1MEN1KMT2A | |
| SCHEMBL8547192 | 0.79 | ALDH1A1 (0.48) | ROCK2ALDH1A1MAPK1MEN1KMT2A | |
| SCHEMBL3707918 | 0.77 | ROCK2 (0.57) | ROCK2NAMPTALDH1A1MAPK1PARP1 | |
| SCHEMBL8551923 | 0.77 | ALDH1A1 (0.43) | ROCK2NAMPTALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL8549961 | 0.76 | MEN1 (0.44) | ALDH1A1MAPK1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL8552718 | 0.75 | ALDH1A1 (0.42) | ALDH1A1MAPK1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL8547799 | 0.75 | KMT2A (0.43) | ALDH1A1MAPK1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL1786578 | 0.75 | ATM (0.73) | ROCK2ALDH1A1MAPK1MEN1KMT2A | |
| SCHEMBL30602968 | 0.74 | PIK3CA (0.46) | ROCK2NAMPTMAPK1PARP1ATM |
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 |