Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | ELOVL1 | Q9BW60 | 6/20 | 0.42 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27690103 | 0.77 | KMT2A (0.60) | KDM4ECYP2C9GAAMAPTHTT | |
| SCHEMBL9832051 | 0.75 | NPC1 (0.49) | KDM4ECYP2C9GAAMAPTHTT | |
| SCHEMBL10919111 | 0.72 | ELOVL1 (0.45) | KDM4ECYP2C9GAAMAPTHTT | |
| SCHEMBL15603517 | 0.72 | HDAC3 (0.63) | KDM4ECYP2C9GAAMAPTHTT | |
| SCHEMBL28767728 | 0.72 | MAPT (0.52) | KDM4ECYP2C9GAAMAPTHTT | |
| SCHEMBL6971231 | 0.71 | CYP2C9 (0.46) | KDM4ECYP2C9GAAMAPTHTT | |
| SCHEMBL28506929 | 0.71 | ALDH1A1 (0.48) | KDM4EGAAMAPTHTTL3MBTL1 | |
| SCHEMBL5673051 | 0.70 | ALDH1A1 (0.53) | GAAMAPTHTTHSD17B10L3MBTL1 | |
| SCHEMBL5823369 | 0.69 | ABCB11 (0.51) | KDM4ECYP2C9GAAMAPTHTT | |
| SCHEMBL7757989 | 0.69 | CYP2C9 (0.43) | KDM4ECYP2C9GAAMAPTHTT |
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-105669531-B | The prodrug of non-steroidal anti-inflammatory drugs with fast skin and membranes penetration speed and its new medical usage | 于崇曦 | 2019-05-07 | — | — | CN | disclosed |