Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | DHODH | Q02127 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | HPGDS | O60760 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29646083 | 0.88 | MAPT (0.35) | P2RX7LMNATP53MAPK1NTSR1 | |
| SCHEMBL29646123 | 0.85 | P2RX7 (0.33) | P2RX7TP53HTTKMT2ASMN1; SMN2 | |
| SCHEMBL29645561 | 0.82 | MAP3K5 (0.34) | PIK3CASCN9AP2RX7 | |
| SCHEMBL29645597 | 0.80 | TRPA1 (0.34) | P2RX7DHODHHDAC6HPGDS | |
| SCHEMBL29645992 | 0.80 | P2RX7 (0.31) | PIK3CAP2RX7 | |
| SCHEMBL29645682 | 0.80 | ADORA3 (0.40) | P2RX7TP53SMN1; SMN2 | |
| SCHEMBL29645738 | 0.79 | NTRK1 (0.36) | SCN9AP2RX7HPGDS | |
| SCHEMBL29645914 | 0.79 | NR1H2 (0.40) | P2RX7 | |
| SCHEMBL22988444 | 0.79 | ADORA2A (0.35) | LMNATP53HTTKMT2AHDAC6 | |
| SCHEMBL29646221 | 0.79 | CYP1A2 (0.35) | P2RX7DHODHHDAC6HPGDS |
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-114466850-A | [1,2,4] triazolo [1,5-C ] quinazolin-5-amines | 拜耳股份有限公司 | 2022-05-10 | — | — | CN | claimed |