Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19986564 | 0.93 | NAMPT (0.52) | KMT2ANPC1RAB9AALDH1A1POLB | |
| SCHEMBL19986554 | 0.90 | MEN1 (0.47) | KMT2AALDH1A1NAMPTMEN1LMNA | |
| SCHEMBL19986507 | 0.88 | KMT2A (0.38) | KMT2ATP53ALDH1A1NAMPTMEN1 | |
| SCHEMBL19986671 | 0.86 | EPHX2 (0.49) | KMT2ATP53NPC1RAB9AALDH1A1 | |
| SCHEMBL19986699 | 0.84 | LMNA (0.53) | KMT2ATP53NPC1RAB9APOLB | |
| SCHEMBL19986631 | 0.81 | KMT2A (0.53) | KMT2ATP53NPC1RAB9AALDH1A1 | |
| SCHEMBL19986563 | 0.78 | MEN1 (0.53) | KMT2ATP53NPC1NAMPTMEN1 | |
| SCHEMBL19986445 | 0.78 | MEN1 (0.50) | KMT2ATP53NPC1RAB9ANAMPT | |
| SCHEMBL19986553 | 0.76 | KMT2A (0.63) | KMT2ATP53NPC1RAB9AALDH1A1 | |
| SCHEMBL24474146 | 0.76 | ALDH1A1 (0.56) | KMT2ATP53NPC1RAB9AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018050110-A1 | NOVEL CAPSID PROTEIN ASSEMBLY INHIBITOR | 正大天晴药业集团股份有限公司 | 2018-03-22 | — | — | WO | disclosed |