Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.66 |
| ▸ | KDR | P35968 | 3/20 | 0.62 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.61 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | NAMPT | P43490 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | CNR1 | P21554 | 1/20 | 0.55 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL28607855 | 1.00 | HDAC1 (0.66) | HDAC1KDRMKNK1MKNK2NPC1 | |
| SCHEMBL1109339 | 0.90 | MKNK1 (0.73) | HDAC1MKNK1MKNK2NPC1RAB9A | |
| SCHEMBL28623099 | 0.89 | KDR (0.62) | HDAC1KDRNPC1RAB9ANAMPT | |
| SCHEMBL30209636 | 0.89 | KDR (0.62) | HDAC1KDRNPC1RAB9ANAMPT | |
| SCHEMBL28613002 | 0.84 | HDAC1 (0.77) | HDAC1GAACNR1HDAC6CYP3A4 | |
| SCHEMBL14082508 | 0.81 | POLB (0.77) | MKNK1MKNK2NPC1RAB9ANAMPT | |
| SCHEMBL3038840 | 0.81 | NAMPT (0.81) | NPC1RAB9ANAMPTLMNAGAA | |
| SCHEMBL14082506 | 0.81 | NAMPT (0.86) | MKNK1MKNK2NPC1RAB9ANAMPT | |
| SCHEMBL4911349 | 0.81 | CNR1 (0.80) | KDRNPC1RAB9ANAMPTLMNA | |
| SCHEMBL14082509 | 0.81 | CYP11B1 (0.72) | MKNK1MKNK2NPC1RAB9ANAMPT |
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-113288888-B | Compounds with vasodilating activity | 烟台邦杰生物科技有限公司 | 2023-02-03 | — | — | CN | claimed |
| CN-113288888-B | Compounds with vasodilating activity | 烟台邦杰生物科技有限公司 | 2023-02-03 | — | — | CN | disclosed |