Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.44 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GRM7 | Q14831 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7711581 | 1.00 | KMT2A (0.44) | KMT2APTGS2PTGS1SRCHCAR2 | |
| SCHEMBL4909298 | 1.00 | KMT2A (0.44) | KMT2APTGS2PTGS1SRCHCAR2 | |
| Acetic Acid SCHEMBL27420785 | 0.96 | PTGS2 (0.42) | KMT2APTGS2PTGS1SRCHCAR2 | |
| Acetic Acid SCHEMBL27516772 | 0.96 | PTGS2 (0.42) | KMT2APTGS2PTGS1SRCHCAR2 | |
| Acetic Acid SCHEMBL27542169 | 0.96 | PTGS2 (0.42) | KMT2APTGS2PTGS1SRCHCAR2 | |
| SCHEMBL8076971 | 0.87 | PTGS1 (0.51) | PTGS2PTGS1LMNA | |
| SCHEMBL8076528 | 0.84 | KMT2A (0.41) | KMT2APTGS2LMNA | |
| SCHEMBL29724156 | 0.83 | PTGS2 (0.70) | KMT2APTGS2PTGS1CYP2C19LMNA | |
| SCHEMBL27750532 | 0.83 | LMNA (0.54) | PTGS2PTGS1LMNAL3MBTL1 | |
| SCHEMBL870669 | 0.83 | KMT2A (0.50) | KMT2APTGS2PTGS1HCAR2FAAH |
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 |
|---|---|---|---|---|---|---|---|
| EP-1031629-A2 | Method of preparation of stereoisomeric carboxylic acid esters | BASF AKTIENGESELLSCHAFT (DE) | 2000-08-30 | — | — | EP | disclosed |