Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.59 |
| ▸ | ADRB2 | P07550 | 10/20 | 0.52 |
| ▸ | ADRB3 | P13945 | 11/20 | 0.51 |
| ▸ | ADRB1 | P08588 | 7/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.49 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.49 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8700456 | 1.00 | PTGS2 (0.59) | PTGS2ADRB2ADRB3ADRB1GLA | |
| SCHEMBL8700452 | 1.00 | PTGS2 (0.59) | PTGS2ADRB2ADRB3ADRB1GLA | |
| SCHEMBL8697010 | 0.92 | ADRB3 (0.55) | ADRB2ADRB3ADRB1GLACYP2D6 | |
| SCHEMBL8700159 | 0.92 | ADRB3 (0.55) | ADRB2ADRB3ADRB1GLACYP2D6 | |
| SCHEMBL8700162 | 0.92 | ADRB3 (0.55) | ADRB2ADRB3ADRB1GLACYP2D6 | |
| SCHEMBL8697542 | 0.91 | ADRB2 (0.60) | ADRB2ADRB3ADRB1GLACYP2D6 | |
| SCHEMBL8697543 | 0.91 | ADRB2 (0.60) | ADRB2ADRB3ADRB1GLACYP2D6 | |
| SCHEMBL8697547 | 0.91 | ADRB2 (0.60) | ADRB2ADRB3ADRB1GLACYP2D6 | |
| SCHEMBL8697869 | 0.89 | ADRB2 (0.53) | ADRB2ADRB3ADRB1GLACYP2D6 | |
| SCHEMBL8697556 | 0.89 | ADRB2 (0.53) | ADRB2ADRB3ADRB1GLACYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5767133-A | Secondary amines as antidiabetic and antiobesity agents | PFIZER INC. (US) | 1998-06-16 | — | — | US | disclosed |
| EP-0703911-B1 | SECONDARY AMINES AS ANTIDIABETIC AND ANTIOBESITY AGENTS | PFIZER (US) | 1997-07-02 | — | — | EP | disclosed |