Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | CPB1 | P15086 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL992319 | 0.78 | ALDH1A1 (0.57) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL7049526 | 0.78 | ALDH1A1 (0.63) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL7055323 | 0.78 | ALDH1A1 (0.68) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL15094083 | 0.77 | ALDH1A1 (0.61) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL11229650 | 0.75 | ALDH1A1 (0.53) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL27088345 | 0.75 | ALDH1A1 (0.53) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL1549936 | 0.75 | ALDH1A1 (0.64) | ALDH1A1KMT2ATDP1MAPK1L3MBTL1 | |
| SCHEMBL8467928 | 0.74 | ALDH1A1 (0.63) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL13189381 | 0.74 | ALDH1A1 (0.63) | ALDH1A1KMT2ACA12CA1CA2 | |
| SCHEMBL960 | 0.74 | ALDH1A1 (1.00) | ALDH1A1KMT2ACA12CA1CA2 |
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-1304325-A1 | 5-(M-CYANOBENZYLAMINO)PYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-04-23 | — | — | EP | disclosed |