Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.31 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.31 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.31 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL7014109 | 0.92 | ADRA2A (0.32) | PTGS2ADRA2AADRA2BADRA2CMCHR1 | |
| SCHEMBL8804858 | 0.90 | CYP2D6 (0.36) | ADRA2AADRA2BADRA2CADRA1AMCHR1 | |
| SCHEMBL8879255 | 0.89 | P2RX3 (0.37) | PTGS2ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL8804674 | 0.89 | CARM1 (0.34) | ADRA2AADRA2BADRA2CMCHR1KAT2B | |
| SCHEMBL8806161 | 0.88 | GRIA2 (0.33) | — | |
| SCHEMBL9138413 | 0.88 | DRD3 (0.40) | ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL8186216 | 0.86 | SLC6A4 (0.36) | KAT2B | |
| SCHEMBL9138352 | 0.83 | BACE1 (0.37) | ADRA2AADRA2BADRA2CADRA1AKAT2B | |
| SCHEMBL8177078 | 0.83 | ADRA1A (0.35) | ADRA2AADRA2BADRA2CADRA1AKAT2B | |
| SCHEMBL8804087 | 0.82 | TSHR (0.35) | ADRA2AADRA2BADRA2CADRA1ATP53 |
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-5475105-A | N-substituted azabicycloheptane derivatives | BASF AKTIENGESELLSCHAFT (DE) | 1995-12-12 | — | — | US | disclosed |