Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.35 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.32 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.32 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.32 |
| ▸ | ALB | P02768 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16957671 | 0.83 | LMNA (0.46) | PTGS2SLC7A5KMT2ASMN1; SMN2POLB | |
| SCHEMBL17749145 | 0.80 | ALOX15 (0.44) | PTGS2SLC7A5KMT2ASMN1; SMN2L3MBTL1 | |
| SCHEMBL2425203 | 0.80 | THRB (0.46) | THRBTSHRKMT2ASMN1; SMN2LMNA | |
| SCHEMBL15189053 | 0.80 | THRB (0.46) | THRBTSHRKMT2ASMN1; SMN2LMNA | |
| SCHEMBL4596417 | 0.78 | THRB (0.63) | THRBTSHRPTGS2FAAHPTGS1 | |
| SCHEMBL15267204 | 0.73 | TACR1 (0.45) | KMT2A | |
| SCHEMBL16953194 | 0.72 | CYP4F2 (0.39) | THRBPTGS2KMT2ASMN1; SMN2POLB | |
| SCHEMBL16950788 | 0.72 | KDM4E (0.42) | PTGS2KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1433687 | 0.71 | TPMT (0.53) | THRBKMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17756345 | 0.71 | CYP3A4 (0.51) | PTGS2NPC1RAB9ASMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016074118-A1 | IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2016-05-19 | — | — | WO | disclosed |