Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 2/20 | 0.50 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.50 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL7235686 | 0.95 | CLK1 (0.54) | CLK1CSNK1DCSNK1EDYRK1AALDH1A1 | |
| SCHEMBL4750534 | 0.95 | CLK1 (0.54) | CLK1CSNK1DCSNK1EDYRK1AALDH1A1 | |
| Quinoline SCHEMBL7992158 | 0.92 | ALDH1A1 (0.57) | CLK1CSNK1DCSNK1EDYRK1AALDH1A1 | |
| SCHEMBL29726025 | 0.83 | ALDH1A1 (0.61) | DYRK1AALDH1A1NPC1POLBRAB9A | |
| SCHEMBL50867 | 0.83 | ALDH1A1 (0.61) | DYRK1AALDH1A1NPC1POLBRAB9A | |
| Anthracene SCHEMBL29011110 | 0.83 | CYP19A1 (0.50) | CLK1CSNK1DCSNK1EDYRK1APOLB | |
| Isoquinoline SCHEMBL1505711 | 0.82 | ALDH1A1 (0.68) | CLK1ALDH1A1NPC1POLBRAB9A | |
| Isoquinoline SCHEMBL27938240 | 0.82 | ALDH1A1 (0.68) | CLK1ALDH1A1NPC1POLBRAB9A | |
| SCHEMBL29066655 | 0.81 | ALDH1A1 (0.58) | DYRK1AALDH1A1NPC1POLBRAB9A | |
| SCHEMBL31733917 | 0.81 | ALDH1A1 (0.58) | DYRK1AALDH1A1NPC1POLBRAB9A |
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-2001017997-A1 | SUBSTITUTED DIAZAANTHRACENE COMPOUNDS HAVING PHARMACEUTICAL UTILITY | DIAZANS LIMITED (CA) | 2001-03-15 | — | — | WO | disclosed |