Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.33 |
| ▸ | PRNP | P04156 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2431371 | 0.91 | ALDH1A1 (0.44) | ALDH1A1KMT2ASMN1; SMN2NPSR1HPGD | |
| SCHEMBL2431376 | 0.91 | ALDH1A1 (0.44) | ALDH1A1KMT2ASMN1; SMN2NPSR1HPGD | |
| SCHEMBL989690 | 0.89 | ALDH1A1 (0.42) | ALDH1A1KMT2ASMN1; SMN2NPSR1HPGD | |
| SCHEMBL2107036 | 0.89 | ALDH1A1 (0.42) | ALDH1A1KMT2ASMN1; SMN2NPSR1HPGD | |
| SCHEMBL2873409 | 0.87 | ALDH1A1 (0.41) | ALDH1A1KMT2ASMN1; SMN2NPSR1HPGD | |
| SCHEMBL2873412 | 0.87 | ALDH1A1 (0.41) | ALDH1A1KMT2ASMN1; SMN2NPSR1HPGD | |
| SCHEMBL14290920 | 0.87 | ALDH1A1 (0.41) | ALDH1A1KMT2ASMN1; SMN2NPSR1HPGD | |
| SCHEMBL2878267 | 0.86 | ALDH1A1 (0.45) | ALDH1A1KMT2ASMN1; SMN2NPSR1HPGD | |
| SCHEMBL2878269 | 0.86 | ALDH1A1 (0.45) | ALDH1A1KMT2ASMN1; SMN2NPSR1HPGD | |
| SCHEMBL1440210 | 0.84 | KMT2A (0.35) | ALDH1A1KMT2ASMN1; SMN2NPSR1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011011303-A1 | INHIBITORS OF FLAVIVIRIDAE VIRUSES | GILEAD SCIENCES, INC. (US) | 2011-01-27 | — | — | WO | disclosed |