Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 2/20 | 0.43 |
| ▸ | PPARD | Q03181 | 2/20 | 0.43 |
| ▸ | PPARA | Q07869 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.40 |
| ▸ | MEN1 | O00255 | 5/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9288147 | 0.86 | CYP2C19 (0.47) | CYP2C19PPARGPPARDPPARAKMT2A | |
| SCHEMBL9435626 | 0.81 | LMNA (0.41) | KMT2AMEN1HTTLMNARXRA | |
| SCHEMBL13757708 | 0.80 | CYP2C19 (0.54) | CYP2C19PPARGPPARDPPARAKMT2A | |
| SCHEMBL7846867 | 0.77 | CYP2C19 (0.51) | CYP2C19KMT2AMEN1HTTLMNA | |
| SCHEMBL7844241 | 0.77 | CYP2C19 (0.51) | CYP2C19KMT2AMEN1HTTLMNA | |
| SCHEMBL20669301 | 0.77 | PTGDR2 (0.51) | CYP2C19KMT2AMEN1HTTLMNA | |
| SCHEMBL13321439 | 0.76 | CYP2C19 (0.50) | CYP2C19PPARGPPARDPPARAKMT2A | |
| SCHEMBL13757721 | 0.75 | CYP2C19 (0.49) | CYP2C19PPARGPPARDPPARAKMT2A | |
| SCHEMBL9342307 | 0.74 | ESR1 (0.43) | CYP2C19RXRARXRBRXRGALDH1A1 | |
| SCHEMBL9343298 | 0.73 | CYP2C19 (0.54) | CYP2C19RXRARXRBRXRGSMN1; SMN2 |
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-5449682-A | Angiotensin II antagonists incorporating a substituted benzyl element | MERCK & CO., INC. (US) | 1995-09-12 | — | — | US | disclosed |
| US-5240938-A | Angiotensin II antagonists incorporating a substituted pyridoimidazolyl ring | MERCK & CO., INC. (US) | 1993-08-31 | — | — | US | disclosed |
| WO-1991011999-A1 | ANGIOTENSIN II ANTAGONISTS INCORPORATING A SUBSTITUTED BENZYL ELEMENT | MERCK & CO., INC. (US) | 1991-08-22 | — | — | WO | disclosed |