Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB1 | P46663 | 13/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29131122 | 0.83 | BDKRB1 (0.38) | BDKRB1CA12CA1CA2CA7 | |
| SCHEMBL29131126 | 0.82 | CNR2 (0.40) | BDKRB1CA12CA1CA2CA7 | |
| SCHEMBL29131091 | 0.81 | BDKRB1 (0.38) | BDKRB1MEN1KMT2A | |
| SCHEMBL29026652 | 0.79 | BDKRB1 (0.47) | BDKRB1MEN1KMT2ACA12CA1 | |
| SCHEMBL29131129 | 0.79 | SLC6A3 (0.35) | BDKRB1MEN1KMT2AHPGD | |
| SCHEMBL29026633 | 0.77 | LMNA (0.49) | BDKRB1LMNASMN1; SMN2MEN1MAPT | |
| SCHEMBL1585568 | 0.74 | ATR (0.39) | BDKRB1LMNASMN1; SMN2HSP90AA1HSP90B1 | |
| SCHEMBL31401179 | 0.74 | CA12 (0.44) | LMNASMN1; SMN2MEN1MAPTCASP3 | |
| SCHEMBL4203546 | 0.74 | CA12 (0.44) | LMNASMN1; SMN2MEN1MAPTCASP3 | |
| SCHEMBL2334086 | 0.74 | DPP4 (0.46) | BDKRB1LMNASMN1; SMN2MEN1MAPT |
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-117903192-A | Preparation method of 3-methoxy isoquinoline compound intermediate | 上海相辉医药科技有限公司 | 2024-04-19 | — | — | CN | claimed |