Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31015909 | 0.80 | SIGMAR1 (0.43) | CYP2D6TSHRCYP2C19CYP1A2PKM | |
| SCHEMBL1441712 | 0.78 | PKM (0.41) | CYP2D6TSHRCYP2C19CYP1A2PKM | |
| SCHEMBL8041965 | 0.76 | CYP2D6 (0.43) | CYP2D6TSHRCYP2C19CYP1A2PKM | |
| SCHEMBL23811463 | 0.75 | CYP2D6 (0.39) | CYP2D6TSHRCYP2C19CYP1A2PKM | |
| SCHEMBL10382409 | 0.75 | CYP2C19 (0.39) | CYP2D6TSHRCYP2C19CYP1A2PKM | |
| SCHEMBL888447 | 0.75 | TSHR (0.39) | CYP2D6TSHRCYP2C19CYP1A2PKM | |
| SCHEMBL18536298 | 0.75 | CYP2D6 (0.39) | CYP2D6TSHRCYP2C19CYP1A2PKM | |
| SCHEMBL14919416 | 0.75 | POLB (0.51) | TSHRSMN1; SMN2LMNAMAOAMAOB | |
| SCHEMBL24043403 | 0.73 | CYP2D6 (0.38) | CYP2D6TSHRCYP2C19CYP1A2PKM | |
| SCHEMBL2023897 | 0.73 | MAOA (0.42) | CYP2D6TSHRCYP2C19CYP1A2PKM |
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 |
|---|---|---|---|---|---|---|---|
| CN-108558889-A | Bu Luomo structural domain inhibitor | 赛尔基因昆蒂赛尔研究公司 | 2018-09-21 | — | — | CN | disclosed |