Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 6/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2966767 | 0.83 | ADRB2 (0.51) | ADRB2CYP2D6ADRB1CYP1A2TSHR | |
| SCHEMBL14117385 | 0.80 | ADRB2 (0.49) | ADRB2CYP2D6ADRB1CYP1A2TSHR | |
| SCHEMBL1230900 | 0.77 | ADRB2 (0.63) | ADRB2CYP2D6ADRB1CYP1A2TSHR | |
| SCHEMBL12158793 | 0.73 | ADRB2 (0.66) | ADRB2CYP2D6ADRB1CYP1A2TSHR | |
| SCHEMBL6838978 | 0.73 | ADRB2 (0.66) | ADRB2CYP2D6ADRB1CYP1A2TSHR | |
| SCHEMBL13240114 | 0.70 | ADRB2 (0.42) | ADRB2ADRB1ADRB3 | |
| SCHEMBL14141543 | 0.68 | ADRB2 (0.62) | ADRB2CYP2D6ADRB1CYP1A2TSHR | |
| SCHEMBL7778381 | 0.68 | ADRB2 (0.56) | ADRB2CYP2D6ADRB1CYP1A2TSHR | |
| SCHEMBL5145221 | 0.68 | ADRB2 (0.56) | ADRB2CYP2D6ADRB1CYP1A2TSHR | |
| SCHEMBL7775809 | 0.68 | ADRB2 (0.56) | ADRB2CYP2D6ADRB1CYP1A2TSHR |
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-7378412-B2 | Pharmaceutical compounds | NICOX S.A. (FR) | 2008-05-27 | — | — | US | disclosed |