Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.31 |
| ▸ | PI4KA | P42356 | 2/20 | 0.31 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.31 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.31 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 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 | |
|---|---|---|---|---|
| SCHEMBL11996764 | 0.74 | HDAC1 (0.48) | HDAC1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL7865703 | 0.73 | HDAC1 (0.52) | HDAC1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL3477216 | 0.73 | CYP2A6 (0.52) | HDAC1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL26500185 | 0.68 | HDAC1 (0.43) | HDAC1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL10160999 | 0.68 | HDAC1 (0.43) | HDAC1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL6852112 | 0.68 | CYP2A6 (0.56) | HDAC1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL19227845 | 0.68 | HDAC1 (0.47) | HDAC1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL6698000 | 0.68 | CYP2A6 (0.56) | HDAC1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL6851947 | 0.67 | HDAC1 (0.42) | HDAC1KDM4ENPC1MAPTRAB9A | |
| SCHEMBL6851945 | 0.67 | HDAC1 (0.42) | HDAC1KDM4ENPC1MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3555095-A1 | INHIBITORS OF INFLUENZA VIRUS REPLICATION AND USES THEREOF | Sunshine Lake Pharma Co., Ltd. (CN) | 2019-10-23 | — | — | EP | disclosed |
| WO-2018108125-A1 | INHIBITORS OF INFLUENZA VIRUS REPLICATION AND USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2018-06-21 | — | — | WO | disclosed |