Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.50 |
| ▸ | CTSD | P07339 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1922270 | 0.80 | ALDH1A1 (0.50) | ALDH1A1TDP1HSD17B10CTSDTSHR | |
| Water SCHEMBL11606809 | 0.75 | ALDH1A1 (0.45) | ALDH1A1TDP1HSD17B10CTSDTSHR | |
| SCHEMBL5536655 | 0.75 | — | — | |
| SCHEMBL465339 | 0.75 | — | — | |
| SCHEMBL1259441 | 0.75 | — | — | |
| SCHEMBL2462 | 0.75 | — | — | |
| SCHEMBL57468 | 0.75 | — | — | |
| Benzene SCHEMBL28686547 | 0.75 | ALDH1A1 (0.45) | ALDH1A1TDP1HSD17B10CTSDTSHR | |
| Water SCHEMBL11606806 | 0.75 | ALDH1A1 (0.45) | ALDH1A1TDP1HSD17B10CTSDTSHR | |
| SCHEMBL296379 | 0.75 | — | — |
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-6335303-B1 | EFFECTIVE IN POLYMERIZATION OF ALPHA OLEFINS TO HIGH MOLECULAR WEIGHT POLYMERS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2002-01-01 | — | — | US | disclosed |
| WO-1998045039-A1 | POLYMERIZATION CATALYSTS CONTAINING ELECTRON-WITHDRAWING AMIDE LIGANDS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1998-10-15 | — | — | WO | disclosed |