Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.48 |
| ▸ | CA2 | P00918 | 4/20 | 0.48 |
| ▸ | CA12 | O43570 | 3/20 | 0.48 |
| ▸ | CA9 | Q16790 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1692167 | 0.97 | — | — | |
| SCHEMBL331242 | 0.97 | CA1 (0.50) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL820166 | 0.95 | CA1 (0.48) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL18447552 | 0.95 | CA1 (0.48) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL28857708 | 0.95 | CA1 (0.48) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL35746 | 0.95 | CA1 (0.48) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL11808736 | 0.95 | CA1 (0.48) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL2492944 | 0.95 | CA1 (0.48) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL212535 | 0.95 | CA1 (0.48) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL29058156 | 0.95 | CA1 (0.48) | CA1CA2CA12CA9ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105924735-A | Labile paper-plastic composite bag and method of preparation for same | 铜陵方正塑业科技有限公司 | 2016-09-07 | — | — | CN | disclosed |
| US-4356274-A | METAL SALT OF 2-MERCAPTOBENZOTHIAZOLE OR 2,5-DIMERCAPTO-1,3,4-THIADIAZOLE | PENNWALT CORPORATION (US) | 1982-10-26 | — | — | US | disclosed |
| US-3991039-A | A THIURAM DISULFIDE AND AN IRON OR MANGANESE COMPOUND, OR AN IRON OR MANGANESE DITHIOCARBAMATE | PRODUCTS RESEARCH & CHEMICAL CORPORATION (US) | 1976-11-09 | — | — | US | disclosed |