Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 3/20 | 0.35 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.35 |
| ▸ | SCN1A | P35498 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | CYP51A1 | Q16850 | 3/20 | 0.33 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.32 |
| ▸ | LTA4H | P09960 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL122883 | 0.79 | ACACB (0.45) | ACACBMAPTHDAC1HDAC2HDAC8 | |
| SCHEMBL31367756 | 0.76 | SMN1; SMN2 (0.54) | PTGS2SCN1ASCN2ASCN3A | |
| SCHEMBL14150916 | 0.74 | CA1 (0.40) | PTGS2CA1CA2CA5ACA9 | |
| SCHEMBL13637585 | 0.74 | NQO1 (0.56) | PTGS2SCN1ASCN2ASCN3ALTA4H | |
| SCHEMBL6371340 | 0.74 | CYP3A4 (0.46) | ACACBMAPTHDAC1HDAC2HDAC8 | |
| SCHEMBL29145321 | 0.73 | PTGS2 (0.40) | PTGS2CA1CA2CA5ACA9 | |
| SCHEMBL12521736 | 0.73 | ALDH1A3 (0.48) | TP53ACACBMAPT | |
| SCHEMBL15684335 | 0.73 | CYP2C9 (0.51) | PTGS2CA1CA2CA9LTA4H | |
| SCHEMBL28489709 | 0.73 | CYP2C9 (0.49) | PTGS2CA1CA2CA5ACA9 | |
| SCHEMBL14381288 | 0.73 | CYP2C9 (0.51) | PTGS2CA1CA2CA9MAPT |
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-111748216-B | Synthetic method for preparing novel pyrene D-pi-A type solar cell dye through click reaction | 苏州美嘉写智能显示科技有限公司 | 2021-12-31 | — | — | CN | claimed |
| CN-111748216-A | Synthetic method for preparing novel pyrene D-pi-A type solar cell dye through click reaction | 苏州美嘉写智能显示科技有限公司 | 2020-10-09 | — | — | CN | claimed |
| CN-111748216-B | Synthetic method for preparing novel pyrene D-pi-A type solar cell dye through click reaction | 苏州美嘉写智能显示科技有限公司 | 2021-12-31 | — | — | CN | disclosed |
| CN-111748216-A | Synthetic method for preparing novel pyrene D-pi-A type solar cell dye through click reaction | 苏州美嘉写智能显示科技有限公司 | 2020-10-09 | — | — | CN | disclosed |