Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.49 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | CCR2 | P41597 | 4/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | BCAT1 | P54687 | 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 | |
|---|---|---|---|---|
| SCHEMBL7267146 | 0.80 | CA2 (0.62) | CA2AKR1B1KDM4EALDH1A1NPSR1 | |
| SCHEMBL29236234 | 0.77 | PTGES2 (0.43) | CA2KDM4ERAB9ANPC1HDAC1 | |
| SCHEMBL7137894 | 0.77 | CA2 (0.71) | CA2AKR1B1KDM4EALDH1A1NPSR1 | |
| SCHEMBL6254180 | 0.77 | LMNA (0.48) | CA2KDM4EALDH1A1NPSR1CA9 | |
| Oxalic Acid SCHEMBL7276138 | 0.75 | CA2 (0.56) | CA2AKR1B1KDM4EALDH1A1NPSR1 | |
| SCHEMBL2027030 | 0.69 | TDP1 (0.44) | CA2ALDH1A1CA9CA1CA12 | |
| SCHEMBL2025546 | 0.69 | TDP1 (0.44) | CA2ALDH1A1CA9CA1CA12 | |
| SCHEMBL29801708 | 0.69 | TDP1 (0.44) | CA2ALDH1A1CA9CA1CA12 | |
| SCHEMBL4023070 | 0.69 | CA2 (0.65) | CA2AKR1B1KDM4EALDH1A1NPSR1 | |
| Potassium Ion SCHEMBL31120441 | 0.69 | TDP1 (0.44) | CA2ALDH1A1CA9CA1CA12 |
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-116589472-B | Benzofuran [3,2-d ] pyrimidine-2-amine compound and preparation method and application thereof | 郑州大学 | 2024-09-13 | — | — | CN | disclosed |
| CN-116589472-A | Benzofuran [3,2-d ] pyrimidine-2-amine compound and preparation method and application thereof | 郑州大学 | 2023-08-15 | — | — | CN | disclosed |