Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 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 | |
|---|---|---|---|---|
| SCHEMBL4406722 | 0.85 | CA1 (0.50) | CA1CA12CA2CA9CYP19A1 | |
| SCHEMBL29220267 | 0.84 | TSHR (0.39) | CYP19A1ALDH1A1ACHELMNATSHR | |
| SCHEMBL16047302 | 0.81 | CA1 (0.46) | CA1CA12CA2CA9CYP19A1 | |
| SCHEMBL29220138 | 0.79 | CA1 (0.45) | CA1CA12CA2CA9CYP19A1 | |
| SCHEMBL10008869 | 0.79 | HCAR2 (0.39) | ALDH1A1KDM4EGAATDP1MAPK1 | |
| SCHEMBL5503276 | 0.79 | CA1 (0.45) | CA1CA12CA2CA9CYP19A1 | |
| SCHEMBL10008872 | 0.79 | HCAR2 (0.39) | ALDH1A1KDM4EGAATDP1MAPK1 | |
| SCHEMBL996968 | 0.79 | CA1 (0.45) | CA1CA12CA2CA9CYP19A1 | |
| SCHEMBL4679686 | 0.79 | CA1 (0.45) | CA1CA12CA2CA9CYP19A1 | |
| SCHEMBL1869451 | 0.78 | CA1 (0.48) | CA1CA12CA2CA9CYP19A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118108878-A | Organic polymer carrier and preparation method and application thereof | 中国石油天然气股份有限公司 | 2024-05-31 | — | — | CN | claimed |
| CN-118108878-A | Organic polymer carrier and preparation method and application thereof | 中国石油天然气股份有限公司 | 2024-05-31 | — | — | CN | disclosed |