Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | GFER | P55789 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | YWHAG | P61981 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14768426 | 0.87 | GAA (0.70) | ALDH1A1GAAGFERNPC1RAB9A | |
| SCHEMBL30096935 | 0.79 | GAA (0.68) | ALDH1A1GAAGFERNPC1RAB9A | |
| SCHEMBL2127019 | 0.79 | GAA (0.68) | ALDH1A1GAAGFERNPC1RAB9A | |
| SCHEMBL334348 | 0.79 | GAA (0.63) | ALDH1A1GAAGFERNPC1RAB9A | |
| SCHEMBL17124778 | 0.78 | GAA (0.59) | ALDH1A1GAAGFERNPC1RAB9A | |
| SCHEMBL14420076 | 0.77 | ALDH1A1 (0.53) | ALDH1A1GAAGFERNPC1RAB9A | |
| SCHEMBL14768432 | 0.76 | ALDH1A1 (0.56) | ALDH1A1NPC1RAB9ASMN1; SMN2TDP1 | |
| SCHEMBL12419939 | 0.76 | ALDH1A1 (0.54) | ALDH1A1GAAGFERNPC1RAB9A | |
| SCHEMBL9202609 | 0.75 | ALDH1A1 (0.59) | ALDH1A1GAAGFERNPC1RAB9A | |
| SCHEMBL1786183 | 0.75 | NPC1 (0.63) | ALDH1A1GAAGFERNPC1RAB9A |
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-2753599-B1 | BIPHENYL COMPOUNDS FOR USE IN TREATING MALARIA AND OTHER PARASITIC DISORDERS | MEDIZINISCHE HOCHSCHULE HANNOVER (DE) | 2019-06-05 | — | — | EP | disclosed |