Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GALR2 | O43603 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL184737 | 0.79 | ROCK1 (0.47) | ALDH1A1KMT2AMEN1MAPTTEAD4 | |
| SCHEMBL27870338 | 0.78 | MAPT (0.50) | ALDH1A1KMT2AMEN1MAPTTEAD4 | |
| SCHEMBL11810930 | 0.76 | CYP2C9 (0.48) | MAPTDRD1LMNATDP1L3MBTL1 | |
| SCHEMBL27853542 | 0.73 | DRD1 (0.47) | ALDH1A1KMT2AMEN1MAPTTEAD4 | |
| SCHEMBL21258692 | 0.72 | ALDH1A1 (0.61) | ALDH1A1KMT2AMEN1MAPTTEAD4 | |
| SCHEMBL185920 | 0.71 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1MAPTTEAD4 | |
| SCHEMBL21988008 | 0.71 | DRD1 (0.52) | ALDH1A1KMT2AMEN1MAPTTEAD4 | |
| SCHEMBL7710798 | 0.71 | DRD1 (0.52) | ALDH1A1KMT2AMEN1MAPTTEAD4 | |
| SCHEMBL21628043 | 0.71 | TYR (0.46) | MAPK1KDM4ETP53 | |
| SCHEMBL27536724 | 0.70 | APP (0.39) | ALDH1A1MAPTALOX15GFERKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102414177-B | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT | 2014-07-02 | — | — | CN | disclosed |
| CN-102414177-A | Compounds as bradykinin b1 antagonists | BOEHRINGER INGELHEIM INT | 2012-04-11 | — | — | CN | disclosed |