Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.50 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.43 |
| ▸ | GSK3A | P49840 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | MPI | P34949 | 1/20 | 0.40 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9720888 | 0.86 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2KDM4EGAAMAPT | |
| SCHEMBL9720957 | 0.83 | ALDH1A1 (0.67) | ALDH1A1ALDH2ALDH3A1PKMSMN1; SMN2 | |
| SCHEMBL9720913 | 0.82 | NPSR1 (0.55) | ALDH1A1ALDH2ALDH3A1PKMSMN1; SMN2 | |
| SCHEMBL9720912 | 0.81 | MAPT (0.51) | ALDH1A1SMN1; SMN2MAPTRAB9AL3MBTL1 | |
| SCHEMBL9720814 | 0.78 | CDC25A (0.48) | ALDH1A1ALDH2ALDH3A1SMN1; SMN2MAPT | |
| SCHEMBL11369587 | 0.77 | POLB (0.59) | ALDH1A1SMN1; SMN2KDM4EMAPTL3MBTL1 | |
| SCHEMBL9720894 | 0.76 | KDM4E (0.49) | ALDH1A1SMN1; SMN2KDM4EMAPTHTR7 | |
| SCHEMBL9720886 | 0.75 | HTR7 (0.48) | HTR7 | |
| SCHEMBL11374786 | 0.75 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2MAPTTDP1L3MBTL1 | |
| SCHEMBL11373888 | 0.74 | HEXA (0.57) | ALDH1A1SMN1; SMN2KDM4EGAAMAPT |
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-5079247-A | N1 -substituted benz(cd)indol-2-imine compounds as cardiovascular agents | AMERICAN CYANAMID COMPANY (US) | 1992-01-07 | — | — | US | disclosed |