Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL8616101 | 1.00 | ALDH1A1 (0.32) | ALDH1A1CYP3A4ESR1ESR2 | |
| SCHEMBL1081191 | 0.94 | ALDH1A1 (0.34) | ALDH1A1CYP3A4ESR1ESR2 | |
| Cyanate SCHEMBL10596478 | 0.86 | ESR1 (0.32) | ALDH1A1CYP3A4ESR1ESR2 | |
| SCHEMBL7781753 | 0.85 | ALDH1A1 (0.30) | ALDH1A1CYP3A4 | |
| SCHEMBL7647246 | 0.77 | — | — | |
| SCHEMBL28259054 | 0.76 | ESR1 (0.33) | ESR1ESR2 | |
| SCHEMBL434084 | 0.76 | ALDH1A1 (0.34) | ALDH1A1CYP3A4ESR1ESR2 | |
| SCHEMBL264479 | 0.73 | ALDH1A1 (0.54) | ALDH1A1CYP3A4 | |
| SCHEMBL425684 | 0.72 | — | — | |
| SCHEMBL9293471 | 0.71 | ALDH1A1 (0.49) | ALDH1A1CYP3A4 |
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-20080146764-A1 | Solutions of blocked polyimides or polyamideimides | BAYER MATERIALSCIENCE AG (DE) | 2008-06-19 | — | — | US | disclosed |
| US-20020072582-A1 | New coating binders with urea and/or hydantoin structures, a process for their production and their use | BAYER AKTIENGESELLSCHAFT (DE) | 2002-06-13 | — | — | US | disclosed |