Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | CA2 | P00918 | 2/20 | 0.54 |
| ▸ | GABRA1 | P14867 | 7/20 | 0.50 |
| ▸ | GABRB1 | P18505 | 6/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.50 |
| ▸ | GSR | P00390 | 1/20 | 0.47 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.43 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.43 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28825268 | 0.98 | CA1 (0.52) | CA1CA2GABRA1GABRB1GABRB2 | |
| Lithium SCHEMBL29859773 | 0.98 | CA1 (0.52) | CA1CA2GABRA1GABRB1GABRB2 | |
| SCHEMBL29132846 | 0.78 | — | — | |
| SCHEMBL28839082 | 0.77 | CA1 (0.58) | CA1CA2GABRA1GABRB1GABRB2 | |
| Lithium SCHEMBL30621947 | 0.76 | CA1 (0.56) | CA1CA2GABRA1GABRB1GABRB2 | |
| SCHEMBL29132817 | 0.76 | CA1 (0.56) | CA1CA2GABRA1GABRB1GABRB2 | |
| SCHEMBL2854879 | 0.73 | GSR (0.61) | CA1CA2GABRA1GABRB1GABRB2 | |
| SCHEMBL9195415 | 0.71 | GABRA1 (0.51) | CA1CA2GABRA1GABRB1GABRB2 | |
| SCHEMBL1760529 | 0.71 | CA1 (0.70) | CA1CA2GABRA1GABRB1GABRB2 | |
| SCHEMBL275427 | 0.71 | CA1 (1.00) | CA1CA2GABRA1GABRB1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114891137-A | Binuclear four-group metal catalyst for olefin polymerization, and preparation method, composition and application thereof | 中国科学院长春应用化学研究所 | 2022-08-12 | — | — | CN | disclosed |