Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | AGXT | P21549 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.30 |
| ▸ | WNT3A | P56704 | 1/20 | 0.30 |
| ▸ | KDM1A | O60341 | 1/20 | 0.30 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.30 |
| ▸ | SELE | P16581 | 1/20 | 0.30 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15274414 | 0.95 | CYP2A6 (0.38) | CYP2A6ADRB2ASIC3LOXL2CA12 | |
| SCHEMBL12278319 | 0.88 | CYP2A6 (0.32) | CYP2A6ADRB2CA12CA2 | |
| SCHEMBL23352341 | 0.86 | CYP2A6 (0.35) | CYP2A6ADRB2ASIC3LOXL2CA12 | |
| SCHEMBL12278332 | 0.84 | CYP2A6 (0.32) | CYP2A6ADRB2CA12CA2 | |
| SCHEMBL23352342 | 0.81 | GPR35 (0.37) | CYP2A6ADRB2CA12CA2HSD17B10 | |
| SCHEMBL9980132 | 0.78 | MAPK1 (0.39) | CYP2A6ADRB2ASIC3LOXL2AGXT | |
| SCHEMBL4417258 | 0.76 | CYP2A6 (0.36) | CYP2A6CA12CA2DYRK1A | |
| SCHEMBL4424866 | 0.76 | BACE1 (0.42) | CYP2A6CA12CA2DYRK1A | |
| SCHEMBL18371547 | 0.76 | CYP2A6 (0.30) | CYP2A6 | |
| SCHEMBL12278398 | 0.76 | CYP2A6 (0.30) | CYP2A6 |
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-20200411781-A1 | ORGANIC FIELD EFFECT TRANSISTOR COMPRISING SEMICONDUCTING SINGLE-WALLED CARBON NANOTUBES AND ORGANIC SEMICONDUCTING MATERIAL | CLAP CO., LTD. (KR) | 2020-12-31 | — | — | US | disclosed |