Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.55 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | OGT | O15294 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 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 | |
|---|---|---|---|---|
| SCHEMBL31469512 | 0.97 | PTGS2 (0.52) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL28230416 | 0.84 | PTGS2 (0.56) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL28229596 | 0.83 | PTGS2 (0.41) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL28459879 | 0.83 | PTGS2 (0.57) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL28451943 | 0.83 | PTGS2 (0.57) | PTGS2PTGS1CA1CA2CA5A | |
| SCHEMBL29710493 | 0.82 | CA2 (0.55) | CA12CA1CA2CA9CA5A | |
| SCHEMBL28559130 | 0.82 | CA2 (0.55) | CA12CA1CA2CA9CA5A | |
| SCHEMBL28392918 | 0.81 | PTGS2 (0.48) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL31469506 | 0.81 | KEAP1 (0.45) | PTGS2PTGS1CA12CA1CA2 | |
| SCHEMBL29710494 | 0.81 | KEAP1 (0.44) | PTGS2PTGS1CA12CA1CA2 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108218917-B | Preparation method of (1-aminovinyl) phosphine oxide derivative | 广西大学 | 2020-08-18 | — | — | CN | claimed |
| CN-119490463-A | Beta-triazole derivative and synthetic method and application thereof | 华东师范大学 | 2025-02-21 | — | — | CN | disclosed |
| CN-116178286-B | N (N)2Alkyl substituted triazole derivative and synthetic method and application thereof | 华东师范大学 | 2024-12-03 | — | — | CN | disclosed |
| CN-116178286-A | High-selectivity N 2 Alkyl substituted triazole derivative and synthetic method and application thereof | 华东师范大学 | 2023-05-30 | — | — | CN | disclosed |
| CN-111170955-B | Green preparation method of 2H-1,2,3-triazole compound | 河南师范大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-112125891-B | N2Selective tetrahydrofuran/tetrahydrothiophene substituted triazole derivative and synthesis method and application thereof | 华东师范大学 | 2022-06-07 | — | — | CN | disclosed |
| CN-112125891-A | N2Selective tetrahydrofuran/tetrahydrothiophene substituted triazole derivative and synthesis method and application thereof | 华东师范大学 | 2020-12-25 | — | — | CN | disclosed |
| CN-108218917-B | Preparation method of (1-aminovinyl) phosphine oxide derivative | 广西大学 | 2020-08-18 | — | — | CN | disclosed |
| CN-111170955-A | Green preparation method of 2H-1,2, 3-triazole compound | 河南师范大学 | 2020-05-19 | — | — | CN | disclosed |
| CN-108218917-A | A kind of (1- amine vinyls) phosphine oxygen derivative and preparation method thereof | 广西大学 | 2018-06-29 | — | — | CN | disclosed |