Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 8/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.41 |
| ▸ | IDO1 | P14902 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TDO2 | P48775 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28343059 | 0.87 | IDO1 (0.51) | PTGDR2CYP19A1IDO1HPGDTDO2 | |
| SCHEMBL28328678 | 0.81 | PTGER4 (0.54) | PTGDR2SMN1; SMN2HTTPTGER4 | |
| SCHEMBL28328763 | 0.78 | CYP19A1 (0.48) | PTGDR2CYP19A1IDO1HPGDTDO2 | |
| SCHEMBL28329955 | 0.78 | PTGER4 (0.55) | PTGDR2SMN1; SMN2HTTPTGER4POLB | |
| SCHEMBL28328682 | 0.77 | TGM2 (0.44) | PTGDR2KDM4E | |
| SCHEMBL28329954 | 0.76 | CNR2 (0.48) | PTGDR2SMN1; SMN2HTTCYP1A2POLB | |
| SCHEMBL28329963 | 0.75 | AKR1B1 (0.42) | PTGDR2IDO1HPGDHTTPTGER4 | |
| SCHEMBL28328680 | 0.70 | ALDH1A1 (0.52) | IDO1HPGDPOLBKDM4E | |
| SCHEMBL28345333 | 0.70 | NPC1 (0.53) | PTGDR2IDO1TDO2SMN1; SMN2HTT | |
| SCHEMBL22698975 | 0.68 | TDO2 (0.81) | IDO1HPGDTDO2SMN1; SMN2MAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110498773-B | Method for synthesizing 1, 4-substituted 1,2, 3-triazole from acetylenic acid | 乐山师范学院 | 2021-07-02 | — | — | CN | disclosed |
| CN-110526875-A | A kind of acetylenic acid multicomponent synthesis 1,4- replaces the method for 1,2,3- triazole | UNIV LESHAN NORMAL | 2019-12-03 | — | — | CN | disclosed |
| CN-110498772-A | A kind of Terminal Acetylenes multicomponent synthesis 1,4- replaces the method for 1,2,3- triazole | UNIV LESHAN NORMAL | 2019-11-26 | — | — | CN | disclosed |
| CN-110498773-A | A kind of acetylenic acid synthesis 1,4- replaces the method for 1,2,3- triazole | UNIV LESHAN NORMAL | 2019-11-26 | — | — | CN | disclosed |