Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.49 |
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.42 |
| ▸ | MLYCD | O95822 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8777028 | 0.83 | CES1 (0.51) | CES1SRCALDH1A1TDP1TSHR | |
| SCHEMBL28536864 | 0.83 | CES1 (0.51) | CES1SRCNPC1RAB9AALDH1A1 | |
| SCHEMBL28569931 | 0.79 | CES1 (0.55) | CES1SRCALDH1A1HPGDTDP1 | |
| SCHEMBL6223784 | 0.79 | CES1 (0.55) | CES1SRCNPC1ALDH1A1HPGD | |
| SCHEMBL2543709 | 0.79 | CES1 (0.47) | CES1SRCTSHR | |
| SCHEMBL28567912 | 0.79 | CES1 (0.47) | CES1SRCNPC1RAB9AALDH1A1 | |
| SCHEMBL6350308 | 0.79 | POLB (0.43) | NPC1RAB9AALDH1A1MGLLHDAC3 | |
| SCHEMBL28575903 | 0.78 | CES1 (0.47) | CES1SRCALDH1A1TSHR | |
| SCHEMBL9015197 | 0.78 | CES1 (0.47) | CES1SRCALDH1A1TSHR | |
| SCHEMBL28924771 | 0.78 | CES1 (0.46) | CES1SRCALDH1A1TDP1TSHR |
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-113321815-B | MOF material with phospholipid bilayer grafted on surface, preparation method and application | 天津工业大学 | 2022-03-08 | — | — | CN | disclosed |
| CN-113321815-A | MOF material with phospholipid bilayer grafted on surface, preparation method and application | 天津工业大学 | 2021-08-31 | — | — | CN | disclosed |