Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | TDP2 | O95551 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7599727 | 0.83 | PTPN1 (0.33) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL796674 | 0.81 | CNR2 (0.34) | SLC6A4HTR7MEN1KMT2A | |
| Hexane SCHEMBL8604591 | 0.80 | CNR1 (0.37) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL797421 | 0.78 | ALOX15 (0.33) | ALDH1A1SLC6A4L3MBTL1HTR7 | |
| SCHEMBL4622950 | 0.77 | ALDH1A1 (0.36) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL7039658 | 0.77 | ALDH1A1 (0.36) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL30229819 | 0.77 | ALDH1A1 (0.37) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL5860453 | 0.77 | ALDH1A1 (0.37) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL17952999 | 0.77 | ALDH1A1 (0.37) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL3996671 | 0.76 | SLC6A4 (0.35) | CA12CA1CA2CA9ALDH1A1 |
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-6410665-B1 | POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN | BASELL POLYOLEFINE GMBH (DE) | 2002-06-25 | — | — | US | claimed |
| US-6410665-B1 | POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN | BASELL POLYOLEFINE GMBH (DE) | 2002-06-25 | — | — | US | disclosed |