Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.49 |
| ▸ | CA1 | P00915 | 4/20 | 0.49 |
| ▸ | CA2 | P00918 | 4/20 | 0.49 |
| ▸ | CA9 | Q16790 | 4/20 | 0.49 |
| ▸ | CA7 | P43166 | 3/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.49 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 3/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | P4HB | P07237 | 1/20 | 0.44 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL161684 | 0.86 | CA12 (0.67) | CA12CA1CA2CA9CA7 | |
| SCHEMBL28163777 | 0.80 | CA12 (0.46) | CA12CA1CA2CA9CA7 | |
| SCHEMBL24266071 | 0.80 | TSHR (0.59) | CA12CA1CA2CA9CA7 | |
| SCHEMBL28198900 | 0.78 | CA12 (0.71) | CA12CA1CA2CA9CA7 | |
| SCHEMBL23484189 | 0.78 | ADRB2 (0.56) | CA12CA1CA2CA9CA7 | |
| SCHEMBL11349983 | 0.77 | CA1 (0.57) | CA12CA1CA2CA9CA7 | |
| Methyl 3-Hydroxybenzoate SCHEMBL67203 | 0.76 | P4HB (0.67) | CA12CA1CA2CA9CA7 | |
| Methyl 3-Hydroxybenzoate SCHEMBL29410714 | 0.76 | P4HB (0.67) | CA12CA1CA2CA9CA7 | |
| SCHEMBL28440522 | 0.75 | CA12 (0.61) | CA12CA1CA2CA9CA14 | |
| SCHEMBL3505386 | 0.75 | ESR1 (0.68) | CA12CA1CA2CA9CA6 |
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-107722241-B | A kind of epoxy hardener and its preparation method and application | 万华化学集团股份有限公司 | 2019-09-20 | — | — | CN | disclosed |
| CN-107722241-A | A kind of epoxy hardener and its production and use | 万华化学集团股份有限公司 | 2018-02-23 | — | — | CN | disclosed |