Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | MMP2 | P08253 | 1/20 | 0.51 |
| ▸ | MMP9 | P14780 | 1/20 | 0.51 |
| ▸ | MMP12 | P39900 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TACR1 | P25103 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1401141 | 0.90 | ALDH1A1 (0.48) | HSP90AA1ALDH1A1SMN1; SMN2MAPK1L3MBTL1 | |
| SCHEMBL27771970 | 0.87 | POLB (0.54) | MAOBHSP90AA1MMP2MMP9MMP12 | |
| SCHEMBL15075277 | 0.85 | IDO1 (0.56) | MAOBHSP90AA1MMP2MMP9MMP12 | |
| SCHEMBL2535662 | 0.85 | HSP90AA1 (0.59) | MAOBHSP90AA1MMP2MMP9MMP12 | |
| SCHEMBL11703597 | 0.83 | MMP2 (0.54) | MAOBHSP90AA1MMP2MMP9MMP12 | |
| SCHEMBL6903259 | 0.83 | ALDH1A1 (0.63) | MAOBHSP90AA1MMP2MMP9MMP12 | |
| SCHEMBL20954673 | 0.83 | GLA (0.59) | MAOBHSP90AA1MMP2MMP9MMP12 | |
| SCHEMBL11740218 | 0.83 | ALDH1A1 (0.56) | MAOBHSP90AA1MMP2MMP9MMP12 | |
| SCHEMBL8893780 | 0.82 | MMP2 (0.52) | MAOBHSP90AA1MMP2MMP9MMP12 | |
| M-Xylene SCHEMBL9686508 | 0.81 | ALDH1A1 (0.61) | MAOBHSP90AA1MMP2MMP9MMP12 |
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 |
|---|---|---|---|---|---|---|---|
| US-4044141-A | CORONARY DILATING, SPASMOLYTIC, HYPOTENSIVE AGENTS | BAYER AKTIENGESELLSCHAFT (DT) | 1977-08-23 | — | — | US | disclosed |