Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 6/20 | 0.35 |
| ▸ | PPARA | Q07869 | 6/20 | 0.35 |
| ▸ | PPARD | Q03181 | 2/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 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 | |
|---|---|---|---|---|
| SCHEMBL6563676 | 0.90 | NAMPT (0.42) | PTPN11CYP17A1KMT2APPARGPPARA | |
| SCHEMBL6563283 | 0.84 | PTPN11 (0.46) | PTPN11CYP17A1NR1H4 | |
| SCHEMBL6565434 | 0.83 | PTPN11 (0.41) | PTPN11KMT2AADRB2ADRB1ADRB3 | |
| SCHEMBL7686729 | 0.82 | PTPN11 (0.43) | PTPN11KMT2ANAMPTMEN1 | |
| SCHEMBL7674981 | 0.82 | ABL1 (0.43) | PTPN11KMT2ANAMPTMEN1RAB9A | |
| SCHEMBL6563355 | 0.82 | PTPN11 (0.47) | PTPN11CYP17A1PPARGPPARAPPARD | |
| SCHEMBL6565384 | 0.81 | GRM5 (0.46) | PTPN11KMT2ANAMPTMEN1 | |
| SCHEMBL6561813 | 0.80 | PTPN11 (0.42) | PTPN11NAMPT | |
| SCHEMBL7677130 | 0.80 | PRSS1 (0.41) | KMT2ANPSR1MEN1 | |
| SCHEMBL6561858 | 0.79 | GRM5 (0.47) | PTPN11KMT2ANAMPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1140802-B1 | SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES, THEIR PRODUCTION AND THEIR USE AS MEDICINES | BOEHRINGER INGELHEIM PHARMA (DE) | 2004-03-17 | — | — | EP | disclosed |
| US-6479524-B1 | TO PROLONG THE THROMBIN TIME | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2002-11-12 | — | — | US | disclosed |