Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CCKAR | P32238 | 1/20 | 0.33 |
| ▸ | CCKBR | P32239 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7809784 | 0.83 | CYP2C19 (0.39) | CYP2C19TSHRP2RX7ALDH1A1HPGD | |
| SCHEMBL7949137 | 0.83 | NPC1 (0.36) | CYP2C19TSHRALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL7951047 | 0.78 | TSHR (0.32) | TSHRALDH1A1DRD2 | |
| SCHEMBL7952863 | 0.77 | DRD2 (0.31) | TSHRDRD2 | |
| SCHEMBL5853456 | 0.75 | HPGD (0.37) | CYP2C19P2RX7ALDH1A1HPGDHDAC1 | |
| SCHEMBL5853067 | 0.75 | HPGD (0.37) | CYP2C19P2RX7ALDH1A1HPGDHDAC1 | |
| SCHEMBL5854016 | 0.74 | HPGD (0.35) | CYP2C19P2RX7ALDH1A1HPGDHDAC1 | |
| SCHEMBL5679095 | 0.72 | CYP2C19 (0.41) | CYP2C19TSHRP2RX7ALDH1A1HPGD | |
| SCHEMBL6442092 | 0.72 | CYP2C19 (0.41) | CYP2C19TSHRP2RX7ALDH1A1HPGD | |
| SCHEMBL6468553 | 0.72 | CYP2C19 (0.40) | CYP2C19TSHRP2RX7ALDH1A1HPGD |
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-6268444-B1 | TITANIUM, ZIRCONIUM OR HAFNIUM COMPOUNDS FOR POLYMERIZATION | DOW CHEMICAL COMPANY | 2001-07-31 | — | — | US | claimed |