Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 1.00 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.55 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.52 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.52 |
| ▸ | TYMS | P04818 | 2/20 | 0.49 |
| ▸ | LDHA | P00338 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | FLT3 | P36888 | 3/20 | 0.44 |
| ▸ | GSK3B | P49841 | 3/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28413622 | 0.84 | BCHE (0.71) | BCHENOTUMABCB1ABCG2TYMS | |
| SCHEMBL28645167 | 0.82 | BCHE (0.69) | BCHENOTUMABCB1ABCG2TYMS | |
| SCHEMBL28037853 | 0.79 | FLT3 (0.67) | BCHEABCB1ABCG2LDHAPTGS2 | |
| SCHEMBL28116020 | 0.79 | BCHE (0.66) | BCHEABCB1ABCG2LDHACYP19A1 | |
| SCHEMBL28522923 | 0.79 | BCHE (0.66) | BCHEABCB1ABCG2LDHACYP19A1 | |
| SCHEMBL28661839 | 0.79 | BCHE (0.65) | BCHENOTUMABCB1ABCG2LDHA | |
| SCHEMBL30987381 | 0.77 | BCHE (0.62) | BCHENOTUMABCB1ABCG2LDHA | |
| SCHEMBL17002383 | 0.77 | BCHE (0.62) | BCHEABCB1ABCG2LDHACYP19A1 | |
| SCHEMBL16294830 | 0.76 | BCHE (0.61) | BCHEABCB1ABCG2LDHACYP19A1 | |
| SCHEMBL26628282 | 0.76 | BCHE (0.61) | BCHECYP19A1PTGS2CA12CA1 |
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-110526876-A | A kind of preparation method of organic nitrine and Terminal Acetylenes synthesis 1,4- substitution 1,2,3- triazole | UNIV LESHAN NORMAL | 2019-12-03 | — | — | CN | disclosed |
| CN-105153052-A | Method for preparing 1, 2, 3-triazole type compounds in ion liquid | UNIV HENAN NORMAL | 2015-12-16 | — | — | CN | disclosed |