Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.38 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | BCR | P11274 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL26775153 | 0.92 | PTGS2 (0.36) | PTGS2PTGS1KMT2AAPPENPP3 | |
| SCHEMBL712732 | 0.90 | PTGS2 (0.49) | PTGS2KMT2AAPPABL1ABCB1 | |
| SCHEMBL34420039 | 0.85 | TP53 (0.35) | KMT2ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL19456624 | 0.83 | CYP11B1 (0.40) | APPABL1ABCB1BCRCYP2C19 | |
| SCHEMBL10210065 | 0.81 | MAPT (0.39) | KMT2ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL4755042 | 0.79 | ALDH1A1 (0.41) | PTGS2KMT2ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL31148296 | 0.79 | MAPT (0.33) | KMT2AMAPT | |
| SCHEMBL17197413 | 0.78 | ESR1 (0.39) | KMT2AABL1ABCB1BCRSMN1; SMN2 | |
| SCHEMBL17186624 | 0.78 | HTR2A (0.44) | SMN1; SMN2MAPTKDM4ECYP1A2CYP2D6 | |
| SCHEMBL23055925 | 0.78 | MAPK1 (0.44) | KMT2ASMN1; SMN2MAPTKDM4EBACE1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115215855-A | Electron donor-acceptor type fluorescent molecular compound, and preparation method and application thereof | 上海大学 | 2022-10-21 | — | — | CN | disclosed |