Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CCKAR | P32238 | 1/20 | 0.36 |
| ▸ | CCKBR | P32239 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8008148 | 0.77 | CYP2C19 (0.41) | ALDH1A1HPGDHDAC1HDAC2CYP2C19 | |
| SCHEMBL7743272 | 0.77 | CYP2C19 (0.41) | ALDH1A1HPGDHDAC1HDAC2CYP2C19 | |
| SCHEMBL5676738 | 0.75 | ALDH1A1 (0.41) | ALDH1A1HPGDHDAC1HDAC2CYP2C19 | |
| Butadiene SCHEMBL8463476 | 0.74 | CYP2C19 (0.41) | ALDH1A1HPGDHDAC1HDAC2CYP2C19 | |
| SCHEMBL8463296 | 0.74 | CYP2C19 (0.41) | ALDH1A1HPGDHDAC1HDAC2CYP2C19 | |
| SCHEMBL8465641 | 0.74 | HPGD (0.40) | ALDH1A1HPGDHDAC1HDAC2CYP2C19 | |
| SCHEMBL727244 | 0.74 | — | — | |
| SCHEMBL6471494 | 0.73 | KMT2A (0.38) | HPGDHDAC1HDAC2CYP2C19SMN1; SMN2 | |
| SCHEMBL8463320 | 0.72 | CYP2C19 (0.39) | ALDH1A1HPGDHDAC1HDAC2CYP2C19 | |
| SCHEMBL8820785 | 0.71 | PDCD1 (0.31) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1509552-A1 | SOLID, PARTICULATED, SPRAY DRIED, HETEROGENOUS CATALYST COMPOSITION | Univation Technologies LLC (US) | 2005-03-02 | — | — | EP | disclosed |
| EP-1412365-A1 | SALT OF LEWIS ACID/ACID ADDUCTS AND CATALYST ACTIVATORS THEREFROM | DOW GLOBAL TECHNOLOGIES INC. (US) | 2004-04-28 | — | — | EP | disclosed |
| WO-2003102037-A1 | SOLID, PARTICULATED, SPRAY DRIED, HETEROGENOUS CATALYST COMPOSITION | UNIVATION TECHNOLOGIES, LLC (US) | 2003-12-11 | — | — | WO | disclosed |
| WO-2003010171-A1 | SALT OF LEWIS ACID/ACID ADDUCTS AND CATALYST ACTIVATORS THEREFROM | DOW GLOBAL TECHNOLOGIES, INC. (US) | 2003-02-06 | — | — | WO | disclosed |