Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTR1E | P28566 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL6480023 | 0.90 | ALDH1A1 (0.35) | ALDH1A1CYP3A4PKMCYP2C19NPSR1 | |
| SCHEMBL8654380 | 0.88 | HTR1E (0.34) | ALDH1A1KDM4ERAB9AHTR1ES1PR3 | |
| SCHEMBL8652040 | 0.87 | ADRA1D (0.35) | ADRA1DADRA1AADRA1BALDH1A1KDM4E | |
| SCHEMBL8653878 | 0.85 | ADRA1D (0.33) | ADRA1DADRA1AADRA1BALDH1A1KDM4E | |
| SCHEMBL8652461 | 0.84 | ADRA1D (0.35) | ADRA1DADRA1AADRA1BALDH1A1CYP3A4 | |
| SCHEMBL8653566 | 0.83 | ADRA1D (0.36) | ADRA1DADRA1AADRA1BALDH1A1CYP3A4 | |
| SCHEMBL8650624 | 0.82 | ADRA1D (0.36) | ADRA1DADRA1AADRA1BALDH1A1CYP3A4 | |
| SCHEMBL8886708 | 0.82 | ADRA1D (0.34) | ADRA1DADRA1AADRA1BALDH1A1KDM4E | |
| SCHEMBL8654662 | 0.82 | MAPT (0.39) | ADRA1DADRA1AADRA1BALDH1A1CYP3A4 | |
| SCHEMBL7675801 | 0.81 | EPHX2 (0.37) | ALDH1A1NPSR1 |
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-5847211-A | Substituted 1H-3-Aryl-pyrrolidine-2,4-dione derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1998-12-08 | — | — | US | disclosed |
| US-5622917-A | PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-04-22 | — | — | US | disclosed |