Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LTB4R2 | Q9NPC1 | 7/20 | 0.35 |
| ▸ | LTB4R | Q15722 | 6/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.31 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2639275 | 0.83 | CHRM2 (0.45) | KMT2AALDH1A1LMNARAB9ANPC1 | |
| SCHEMBL6028157 | 0.83 | ACHE (0.39) | LTB4R2HTR1ADRD2HTR7HTR6 | |
| SCHEMBL6016864 | 0.81 | BCHE (0.37) | HTR1ADRD2HTR7HTR6ALDH1A1 | |
| SCHEMBL6022022 | 0.80 | CHRM2 (0.39) | HTR1ADRD2HTR7HTR6ALDH1A1 | |
| SCHEMBL4695275 | 0.79 | CHRM2 (0.35) | KMT2AALDH1A1MAPTCHRNB2CHRNB4 | |
| SCHEMBL6022322 | 0.79 | ADRB2 (0.35) | ALDH1A1 | |
| SCHEMBL4695551 | 0.77 | CNR2 (0.40) | KMT2AHTR1ADRD2HTR7HTR6 | |
| SCHEMBL4691773 | 0.76 | KDM4E (0.41) | KMT2AHTR1ADRD2HTR7HTR6 | |
| SCHEMBL6027475 | 0.76 | TRPV1 (0.37) | HTR1ADRD2HTR7HTR6LMNA | |
| SCHEMBL5281472 | 0.76 | TAAR1 (0.37) | KMT2AALDH1A1L3MBTL1CHRNB2CHRNB4 |
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-1893577-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | Theravance, Inc. (US) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006138218-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | THERAVANCE, INC. (US) | 2006-12-28 | — | — | WO | disclosed |