Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | FASN | P49327 | 1/20 | 0.38 |
| ▸ | LPAR3 | Q9UBY5 | 4/20 | 0.36 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.36 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL5456377 | 1.00 | TSHR (0.43) | TSHRALDH1A1FASNLPAR3LPAR2 | |
| SCHEMBL5458348 | 0.93 | ALDH1A1 (0.47) | TSHRALDH1A1FASNLPAR3LPAR2 | |
| SCHEMBL9699847 | 0.93 | ALDH1A1 (0.47) | TSHRALDH1A1FASNLPAR3LPAR2 | |
| SCHEMBL8754660 | 0.93 | TSHR (0.45) | TSHRALDH1A1FASNLPAR3LPAR2 | |
| SCHEMBL5474004 | 0.91 | ALDH1A1 (0.45) | TSHRALDH1A1FASNLPAR3LPAR2 | |
| SCHEMBL9752818 | 0.91 | ALDH1A1 (0.45) | TSHRALDH1A1FASNLPAR3LPAR2 | |
| SCHEMBL9752819 | 0.91 | ALDH1A1 (0.45) | TSHRALDH1A1FASNLPAR3LPAR2 | |
| SCHEMBL5467430 | 0.91 | TSHR (0.43) | TSHRALDH1A1FASNLPAR3LPAR2 | |
| SCHEMBL6261310 | 0.91 | TSHR (0.43) | TSHRALDH1A1FASNLPAR3LPAR2 | |
| SCHEMBL8674217 | 0.90 | ALDH1A1 (0.53) | TSHRALDH1A1FASNLPAR3LPAR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4078005-A | BROMINATION | CHEMISCHE WERKE HUELS AKTIENGESELLSCHAFT (DT) | 1978-03-07 | — | — | US | claimed |
| WO-2005019138-A2 | PROCESS FOR PRODUCING DETERGENT MOLECULES COMPRISING AN ETHER LINKAGE FROM BUTADIENE | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2005-03-03 | — | — | WO | disclosed |
| US-4078005-A | BROMINATION | CHEMISCHE WERKE HUELS AKTIENGESELLSCHAFT (DT) | 1978-03-07 | — | — | US | disclosed |