Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.65 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.65 |
| ▸ | XDH | P47989 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.58 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.58 |
| ▸ | AHR | P35869 | 2/20 | 0.58 |
| ▸ | NR1I3 | Q14994 | 2/20 | 0.58 |
| ▸ | VDR | P11473 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL2876289 | 0.96 | XDH (0.64) | CLK4DYRK1AXDHCYP1A2CYP3A4 | |
| SCHEMBL29712524 | 0.92 | CYP1A2 (0.67) | CLK4DYRK1ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28315176 | 0.92 | CYP1A2 (0.67) | CLK4DYRK1ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6763922 | 0.88 | CLK4 (0.56) | CLK4DYRK1AXDHCYP1A2CYP3A4 | |
| SCHEMBL30423164 | 0.87 | CLK4 (0.62) | CLK4DYRK1ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL25334573 | 0.87 | CLK4 (0.62) | CLK4DYRK1ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28029282 | 0.85 | CLK4 (0.65) | CLK4DYRK1ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL1180343 | 0.83 | ABL1 (0.69) | CLK4DYRK1AXDHCYP1A2CYP3A4 | |
| SCHEMBL25775018 | 0.83 | CYP1A2 (0.57) | CLK4DYRK1ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL29915339 | 0.81 | DYRK1A (0.61) | CLK4DYRK1ACYP1A2CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-20210151688-A1 | COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE | SAMSUNG SDI CO., LTD. (KR) | 2021-05-20 | — | — | US | disclosed |