Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | THRB | P10828 | 3/20 | 0.37 |
| ▸ | RECQL | P46063 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 2/20 | 0.37 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9767905 | 0.81 | NR1H4 (0.42) | CYP3A4TSHREPHX2NR1H4CA1 | |
| SCHEMBL10583482 | 0.81 | EPHX2 (0.42) | CYP3A4TSHREPHX2NR1H4HSD17B10 | |
| SCHEMBL16291006 | 0.77 | EPHX2 (0.47) | CYP3A4TSHREPHX2NR1H4CA1 | |
| SCHEMBL9767844 | 0.75 | NR1H4 (0.38) | CYP3A4TSHREPHX2NR1H4CA1 | |
| SCHEMBL27388363 | 0.74 | CYP3A4 (0.42) | CYP3A4TSHREPHX2NR1H4CA1 | |
| SCHEMBL10415037 | 0.71 | CYP3A4 (0.43) | CYP3A4TSHREPHX2NR1H4CA1 | |
| SCHEMBL444686 | 0.71 | CYP3A4 (0.52) | CYP3A4TSHRCA1CA2HSD17B10 | |
| SCHEMBL282088 | 0.71 | CYP3A4 (0.52) | CYP3A4TSHREPHX2NR1H4CA1 | |
| SCHEMBL27550571 | 0.71 | NPSR1 (0.40) | CYP3A4TSHREPHX2NR1H4CA1 | |
| SCHEMBL27831631 | 0.71 | NR1H4 (0.39) | CYP3A4TSHREPHX2NR1H4CA1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5013354-A | Tetrahydrophthalimido group, herbicides | BASF AKTIENGESELLSCHAFT (DE) | 1991-05-07 | — | — | US | disclosed |