Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 6/20 | 0.65 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.65 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | NQO2 | P16083 | 3/20 | 0.59 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | GFER | P55789 | 1/20 | 0.56 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.56 |
| ▸ | TUBB | P07437 | 1/20 | 0.56 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.56 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.56 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.56 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL8854378 | 1.00 | CYP1A1 (0.65) | CYP1A1CYP1B1CYP1A2MAPTALDH1A1 | |
| SCHEMBL709522 | 0.91 | CYP1A1 (0.57) | CYP1A1CYP1B1CYP1A2MAPTALDH1A1 | |
| SCHEMBL709523 | 0.91 | CYP1A1 (0.57) | CYP1A1CYP1B1CYP1A2MAPTALDH1A1 | |
| SCHEMBL16592450 | 0.86 | APP (0.74) | CYP1A1CYP1B1CYP1A2MAPTGLA | |
| SCHEMBL16592452 | 0.86 | APP (0.74) | CYP1A1CYP1B1CYP1A2MAPTGLA | |
| SCHEMBL8854590 | 0.86 | APP (0.74) | MAPTNPC1GAARAB9ANFE2L2 | |
| SCHEMBL1388244 | 0.84 | PDE4A (0.54) | CYP1A1CYP1B1CYP1A2ALDH1A1GLA | |
| SCHEMBL1388242 | 0.84 | PDE4A (0.54) | CYP1A1CYP1B1CYP1A2ALDH1A1GLA | |
| SCHEMBL9189623 | 0.84 | TUBB4A (0.65) | CYP1A1CYP1B1CYP1A2MAPTALDH1A1 | |
| SCHEMBL21005800 | 0.84 | TUBB4A (0.65) | CYP1A1CYP1B1CYP1A2MAPTALDH1A1 |
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-3041904-B1 | STYRYL SULFIDE DYES | BASF SE (DE) | 2020-05-20 | — | — | EP | disclosed |