Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13141996 | 0.88 | TAAR1 (0.47) | HTR2ACYP3A4L3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL3475893 | 0.87 | ALDH1A1 (0.41) | HTR2ACYP3A4L3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL7745907 | 0.86 | HTR2A (0.40) | HTR2ACYP3A4L3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL1031784 | 0.86 | HTR2A (0.40) | HTR2ACYP3A4L3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL666868 | 0.86 | HTR2A (0.43) | HTR2ACYP3A4L3MBTL1TAAR1 | |
| SCHEMBL6763498 | 0.82 | HTR2A (0.37) | HTR2ACYP3A4L3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL23201542 | 0.82 | CYP3A4 (0.47) | CYP3A4L3MBTL1ALDH1A1MAPK1CA2 | |
| SCHEMBL10375177 | 0.82 | CYP3A4 (0.43) | CYP3A4L3MBTL1ALDH1A1MAPK1CA2 | |
| SCHEMBL12886723 | 0.80 | ALDH1A1 (0.46) | CYP3A4L3MBTL1ALDH1A1MAPK1CA2 | |
| SCHEMBL7561582 | 0.79 | CYP3A4 (0.44) | HTR2ACYP3A4L3MBTL1ALDH1A1MAPK1 |
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-6426399-B1 | POLYMERIZING DIBROMO-2-METHOXY-5-(2-ETHYLHEXYLOXY)XYLENE WITH POTASSIUM TERT-BUTOXIDE AND ANIONIC INITIATOR WHICH CONTROLS THE MOLECULAR WEIGHT DISTRIBUTION OF THE POLYMER; FOR USE IN LIGHT-EMITTING-DIODES, TRANSISTORS AND PHOTOVOLTAIC CELLS | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM | 2002-07-30 | — | — | US | disclosed |