Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 2/20 | 0.32 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | DHODH | Q02127 | 2/20 | 0.31 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.31 |
| ▸ | CDK2 | P24941 | 2/20 | 0.31 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.31 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18949083 | 1.00 | ADRA2A (0.42) | ADRA2AADRA2BADRA2CGAANOS3 | |
| SCHEMBL18949217 | 1.00 | ADRA2A (0.42) | ADRA2AADRA2BADRA2CGAANOS3 | |
| SCHEMBL18949167 | 1.00 | ADRA2A (0.42) | ADRA2AADRA2BADRA2CGAANOS3 | |
| SCHEMBL10100731 | 0.98 | ADRA2A (0.44) | ADRA2AADRA2BADRA2CGAANOS3 | |
| SCHEMBL12903040 | 0.94 | ADRA2A (0.40) | ADRA2AADRA2BADRA2CGAANOS3 | |
| SCHEMBL19682255 | 0.83 | ADRA2A (0.39) | ADRA2AADRA2BADRA2CGAANOS3 | |
| SCHEMBL18949084 | 0.83 | ADRA2A (0.39) | ADRA2AADRA2BADRA2CCDK5CDK5R1 | |
| SCHEMBL18949087 | 0.83 | ADRA2A (0.39) | ADRA2AADRA2BADRA2CCDK5CDK5R1 | |
| SCHEMBL12398688 | 0.82 | ADRA2A (0.32) | ADRA2AADRA2BADRA2C | |
| SCHEMBL22353570 | 0.80 | ADRA2A (0.37) | ADRA2AADRA2BADRA2CCDK5CDK5R1 |
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-9676748-B2 | Compounds and methods for kinase modulation, and indications therefor | PLEXXIKON INC. (US) | 2017-06-13 | — | — | US | disclosed |