Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.41 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.37 |
| ▸ | SCN1A | P35498 | 1/20 | 0.37 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.37 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL13455319 | 0.79 | CA1 (0.44) | CYP2C9PTGS2CYP51A1CA1CA2 | |
| Ammonia Solution, Strong SCHEMBL28330047 | 0.79 | CYP51A1 (0.40) | CYP2C9PTGS2CYP51A1CA1CA2 | |
| SCHEMBL25983784 | 0.78 | PDE2A (0.58) | CYP2C9ALDH1A1TSHRUSP2GAA | |
| SCHEMBL19962169 | 0.76 | NOS3 (0.50) | PTGS2CYP51A1CA1CA2CA5A | |
| SCHEMBL598140 | 0.76 | ALDH1A1 (0.52) | CYP2C9ALDH1A1TSHRUSP2GAA | |
| SCHEMBL14378840 | 0.74 | HDAC3 (0.40) | CYP2C9ALDH1A1TSHRUSP2GAA | |
| SCHEMBL29145321 | 0.74 | PTGS2 (0.40) | PTGS2CYP51A1CA1CA2CA5A | |
| SCHEMBL28173737 | 0.74 | AKR1C3 (0.43) | PTGS2CYP51A1CA1CA2CA5A | |
| SCHEMBL16748959 | 0.73 | CA1 (0.58) | CYP2C9PTGS2CYP51A1CA1CA2 | |
| SCHEMBL28475146 | 0.73 | PTGS2 (0.39) | PTGS2CYP51A1CA1CA2CA5A |
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 |