Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | GABRP | O00591 | 5/20 | 0.44 |
| ▸ | GABRD | O14764 | 5/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 5/20 | 0.44 |
| ▸ | GABRB1 | P18505 | 5/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 5/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 5/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 5/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 5/20 | 0.44 |
| ▸ | GABRA2 | P47869 | 5/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 5/20 | 0.44 |
| ▸ | GABRA4 | P48169 | 5/20 | 0.44 |
| ▸ | GABRE | P78334 | 5/20 | 0.44 |
| ▸ | GABRA6 | Q16445 | 5/20 | 0.44 |
| ▸ | GABRG1 | Q8N1C3 | 5/20 | 0.44 |
| ▸ | GABRG3 | Q99928 | 5/20 | 0.44 |
| ▸ | GABRQ | Q9UN88 | 5/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.43 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29571824 | 0.96 | CYP2A6 (0.48) | CYP2A6GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL16067567 | 0.96 | CYP2A6 (0.48) | CYP2A6GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL28157068 | 0.89 | CYP2A6 (0.43) | CYP2A6GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL22688479 | 0.89 | CYP2A6 (0.59) | CYP2A6GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL19082483 | 0.86 | CYP2A6 (0.42) | CYP2A6GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL30277934 | 0.85 | CYP2A6 (0.48) | CYP2A6GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29596943 | 0.85 | CYP2A6 (0.48) | CYP2A6GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL10122754 | 0.85 | CYP2A6 (0.48) | CYP2A6GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL13085338 | 0.84 | AHR (0.43) | NPC1MAPTRAB9ASMN1; SMN2CASP1 | |
| SCHEMBL22133389 | 0.84 | AHR (0.49) | CYP2A6GABRPGABRDGABRA1GABRB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11038120-B2 | Organic compound and organic electroluminescence device using the same | LUMINESCENCE TECHNOLOGY CORP. (TW) | 2021-06-15 | — | — | US | disclosed |
| US-20200235310-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME | LUMINESCENCE TECHNOLOGY CORPORATION (TW) | 2020-07-23 | — | — | US | disclosed |