Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 5/20 | 0.51 |
| ▸ | ESR1 | P03372 | 2/20 | 0.51 |
| ▸ | GUSB | P08236 | 4/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | TDP2 | O95551 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 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 | |
|---|---|---|---|---|
| SCHEMBL3497573 | 0.95 | ESR2 (0.56) | ESR2ESR1GUSBPDE4APDE4B | |
| SCHEMBL10252171 | 0.84 | IKBKB (0.45) | PDE4APDE4BPDE4CPDE4DHDAC2 | |
| SCHEMBL9800296 | 0.84 | ESR2 (0.49) | ESR2ESR1GUSBPDE4APDE4B | |
| SCHEMBL14458021 | 0.83 | SMN1; SMN2 (0.43) | PDE4APDE4BPDE4CPDE4DHDAC2 | |
| SCHEMBL7141065 | 0.81 | PDE4A (0.41) | ESR2ESR1GUSBPDE4APDE4B | |
| SCHEMBL6615105 | 0.79 | GAA (0.45) | PDE4APDE4BPDE4CPDE4DHDAC2 | |
| SCHEMBL13945018 | 0.79 | GAA (0.45) | PDE4APDE4BPDE4CPDE4DHDAC2 | |
| SCHEMBL29743248 | 0.77 | ESR2 (0.44) | ESR2ESR1GUSB | |
| SCHEMBL620339 | 0.77 | ESR2 (0.44) | ESR2ESR1GUSB | |
| SCHEMBL23878342 | 0.77 | TDP1 (0.46) | PDE4APDE4BPDE4CPDE4DHDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7250521-B2 | Method for production of Δ1-pyrrolines | BAYER CROPSCIENCE AKTIENGESELLSCHAFT | 2007-07-31 | — | — | US | disclosed |
| US-7250521-B2 | Method for production of Δ1-pyrrolines | BAYER CROPSCIENCE AKTIENGESELLSCHAFT | 2007-07-31 | — | — | US | disclosed |