Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | LMNA | P02545 | 6/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.54 |
| ▸ | HTT | P42858 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 7/20 | 0.45 |
| ▸ | GAA | P10253 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | MPI | P34949 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6245212 | 0.87 | CYP3A4 (0.64) | CYP3A4ADRA2AALDH1A1LMNAKDM4E | |
| SCHEMBL7093738 | 0.84 | DHODH (0.45) | CYP3A4ADRA2AALDH1A1LMNAKDM4E | |
| SCHEMBL13322457 | 0.84 | RORC (0.42) | CYP3A4ADRA2AALDH1A1LMNAKDM4E | |
| SCHEMBL13590029 | 0.82 | ALDH1A1 (0.38) | CYP3A4ADRA2AALDH1A1LMNAKDM4E | |
| SCHEMBL18934422 | 0.80 | CYP3A4 (0.61) | CYP3A4ADRA2AALDH1A1LMNAKDM4E | |
| SCHEMBL13590028 | 0.79 | ESR1 (0.41) | CYP3A4ADRA2AALDH1A1LMNAKDM4E | |
| SCHEMBL13556406 | 0.78 | KMT2A (0.38) | CYP3A4ADRA2AALDH1A1LMNAKDM4E | |
| SCHEMBL10299209 | 0.78 | ALDH1A1 (0.41) | CYP3A4ADRA2AALDH1A1LMNAKDM4E | |
| SCHEMBL21131297 | 0.77 | CYP3A4 (0.62) | CYP3A4ADRA2AALDH1A1LMNAKDM4E | |
| SCHEMBL8292092 | 0.77 | CYP3A4 (0.62) | CYP3A4ADRA2AALDH1A1LMNAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003084662-A2 | COVALENTLY FIXED LIGAND SYSTEMS, NON-METALLOCENE SYSTEMS AND CATALYST SYSTEMS, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF FOR POLYMERIZING OLEFINS | CELANESE VENTURES GMBH (DE) | 2003-10-16 | — | — | WO | disclosed |