Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 7/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CLK1 | P49759 | 1/20 | 0.40 |
| ▸ | F2R | P25116 | 1/20 | 0.39 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30414767 | 1.00 | PTGDR2 (0.50) | PTGDR2CYP19A1MEN1KMT2ATDP1 | |
| SCHEMBL23250037 | 0.91 | CYP19A1 (0.46) | PTGDR2CYP19A1MEN1KMT2AMAPT | |
| SCHEMBL29874201 | 0.91 | CYP19A1 (0.46) | PTGDR2CYP19A1MEN1KMT2AMAPT | |
| SCHEMBL21774713 | 0.88 | PTGS2 (0.46) | CYP19A1MEN1KMT2AMAPTPOLB | |
| SCHEMBL31554738 | 0.87 | CYP19A1 (0.44) | PTGDR2CYP19A1MEN1KMT2AMAPT | |
| SCHEMBL20267284 | 0.87 | BCL6 (0.49) | CYP19A1MEN1KMT2ATDP1MAPT | |
| SCHEMBL29874501 | 0.87 | BCL6 (0.49) | CYP19A1MEN1KMT2ATDP1MAPT | |
| SCHEMBL28555882 | 0.84 | ALDH1A1 (0.48) | CYP19A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL28555880 | 0.84 | ALDH1A1 (0.48) | CYP19A1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL30415372 | 0.82 | MAPT (0.48) | CYP19A1MEN1KMT2AMAPTPOLB |
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-112538083-B | Aromatic ring penta aromatic heterocyclic micromolecule organic compound targeting BCL6, derivative thereof and application thereof | 华东师范大学 | 2023-04-28 | — | — | CN | disclosed |
| CN-112538083-A | Aromatic ring and five-membered aromatic heterocyclic micromolecule organic compound targeting BCL6, derivatives thereof and application thereof | 华东师范大学 | 2021-03-23 | — | — | CN | disclosed |