Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 7/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL13828216 | 0.77 | OPRM1 (0.55) | KCNN4CYP2C19HIF1AHDAC3HDAC4 | |
| SCHEMBL8939158 | 0.74 | KCNN4 (0.48) | KCNN4CYP2C19HIF1ANPSR1KMT2A | |
| SCHEMBL13865461 | 0.72 | KCNN4 (0.47) | KCNN4CYP2C19HIF1AHDAC3HDAC4 | |
| SCHEMBL29679704 | 0.72 | KCNN4 (0.47) | KCNN4CYP2C19HIF1ANPSR1KMT2A | |
| SCHEMBL13868873 | 0.72 | KCNN4 (0.47) | KCNN4CYP2C19HIF1AHDAC3HDAC4 | |
| SCHEMBL14342915 | 0.72 | KCNN4 (0.47) | KCNN4CYP2C19HIF1AHDAC3HDAC4 | |
| SCHEMBL19870991 | 0.72 | KCNN4 (0.57) | KCNN4CYP2C19HIF1AHDAC3HDAC4 | |
| SCHEMBL8939167 | 0.72 | KCNN4 (0.47) | KCNN4CYP2C19HIF1ANPSR1KMT2A | |
| SCHEMBL30534379 | 0.72 | KCNN4 (0.43) | KCNN4CYP2C19HIF1AHDAC3HDAC4 | |
| Hydrochloric Acid SCHEMBL1251198 | 0.71 | KCNN4 (0.45) | KCNN4CYP2C19HIF1AHDAC3HDAC4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118256591-A | Cyclic peptide compound having high membrane permeability and library comprising same | 中外制药株式会社 | 2024-06-28 | — | — | CN | disclosed |
| CN-118184532-A | Amino acid having functional group capable of forming intramolecular hydrogen bond, peptide compound containing the amino acid, and process for producing the same | 中外制药株式会社 | 2024-06-14 | — | — | CN | disclosed |
| CN-113454058-B | Amino acid having functional group capable of forming intramolecular hydrogen bond, peptide compound containing the amino acid, and process for producing the same | 中外制药株式会社 | 2024-03-22 | — | — | CN | disclosed |
| CN-110869544-B | Cyclic peptide compound having high membrane permeability and library comprising same | 中外制药株式会社 | 2024-03-08 | — | — | CN | disclosed |