Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Zinc Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.62 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | BBOX1 | O75936 | 2/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.42 |
| ▸ | KDM4A | O75164 | 1/20 | 0.42 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.42 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.42 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | FABP3 | P05413 | 2/20 | 0.39 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Zinc Ion SCHEMBL5934039 | 0.98 | CA1 (0.65) | CA1NFKB1BBOX1KDM4CKDM4A | |
| SCHEMBL5666381 | 0.98 | CA1 (0.65) | CA1NFKB1BBOX1KDM4CKDM4A | |
| Zinc Ion SCHEMBL29025327 | 0.95 | CA1 (0.62) | CA1NFKB1BBOX1KDM4CKDM4A | |
| SCHEMBL29497545 | 0.95 | CA1 (0.62) | CA1NFKB1BBOX1KDM4CKDM4A | |
| Zinc Ion SCHEMBL29025350 | 0.95 | CA1 (0.62) | CA1NFKB1BBOX1KDM4CKDM4A | |
| Zinc Ion SCHEMBL30979955 | 0.95 | CA1 (0.62) | CA1NFKB1BBOX1KDM4CKDM4A | |
| Zinc Ion SCHEMBL3364891 | 0.95 | CA1 (0.62) | CA1NFKB1BBOX1KDM4CKDM4A | |
| SCHEMBL29670363 | 0.95 | CA1 (0.62) | CA1NFKB1BBOX1KDM4CKDM4A | |
| Zinc Ion SCHEMBL38657576 | 0.95 | CA1 (0.62) | CA1NFKB1BBOX1KDM4CKDM4A | |
| SCHEMBL29670682 | 0.95 | CA1 (0.62) | CA1NFKB1BBOX1KDM4CKDM4A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114940739-A | High-heat-resistance and easy-to-dissolve TPU and preparation method thereof | 万华化学集团股份有限公司 | 2022-08-26 | — | — | CN | claimed |
| CN-111333814-B | Thermoplastic polyurethane, preparation method and application thereof | 万华化学集团股份有限公司 | 2022-01-07 | — | — | CN | claimed |
| CN-111333814-A | Thermoplastic polyurethane, preparation method and application thereof | 万华化学集团股份有限公司 | 2020-06-26 | — | — | CN | claimed |
| CN-114940739-B | High-heat-resistance and easily-soluble TPU and preparation method thereof | 万华化学集团股份有限公司 | 2023-07-11 | — | — | CN | disclosed |
| CN-114940739-A | High-heat-resistance and easy-to-dissolve TPU and preparation method thereof | 万华化学集团股份有限公司 | 2022-08-26 | — | — | CN | disclosed |
| CN-111333814-B | Thermoplastic polyurethane, preparation method and application thereof | 万华化学集团股份有限公司 | 2022-01-07 | — | — | CN | disclosed |
| CN-111333814-A | Thermoplastic polyurethane, preparation method and application thereof | 万华化学集团股份有限公司 | 2020-06-26 | — | — | CN | disclosed |