Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA1 | P02708 | 1/20 | 0.32 |
| ▸ | CHRNG | P07510 | 1/20 | 0.32 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | CHRND | Q07001 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.31 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.30 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9629019 | 0.72 | AQP1 (0.33) | IDO1LOXL2TRPA1TAAR1LMNA | |
| SCHEMBL10413318 | 0.66 | EGFR (0.38) | CHRNA1CHRNGCHRNB1CHRNB2SLC6A2 | |
| SCHEMBL4312272 | 0.63 | TRPA1 (0.43) | SLC6A2SLC6A3IDO1LOXL2TRPA1 | |
| SCHEMBL9577964 | 0.63 | ABCB11 (0.36) | LMNA | |
| SCHEMBL22611647 | 0.61 | IDO1 (0.41) | IDO1LMNA | |
| SCHEMBL9019662 | 0.61 | POLB (0.42) | LMNA | |
| SCHEMBL29003525 | 0.61 | ALDH1A1 (0.39) | IDO1LOXL2TAAR1 | |
| SCHEMBL991292 | 0.60 | SLC6A3 (0.47) | CHRNA1CHRNGCHRNB1CHRNB2SLC6A2 | |
| SCHEMBL14337906 | 0.60 | SLC6A3 (0.44) | SLC6A2SLC6A3IDO1LOXL2TRPA1 | |
| SCHEMBL7292524 | 0.59 | MAOB (0.43) | CHRNA1CHRNGCHRNB1CHRNB2SLC6A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0461502-B1 | Azolyl propanol derivatives | BAYER AG (DE) | 1996-08-28 | — | — | EP | disclosed |
| US-5288883-A | Haloalkyl, benzyl or cycloalkylphenyl chemical intermediates | BAYER AKTIENGESELLSCHAFT (DE) | 1994-02-22 | — | — | US | disclosed |
| US-5216006-A | FUNGICIDAL AZOLYL-PROPANOL DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 1993-06-01 | — | — | US | disclosed |
| EP-0461502-A2 | Azolyl propanol derivatives | BAYER AG (DE) | 1991-12-18 | — | — | EP | disclosed |