Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.60 |
| ▸ | CTSL | P07711 | 9/20 | 0.57 |
| ▸ | CTSK | P43235 | 3/20 | 0.57 |
| ▸ | CTSS | P25774 | 2/20 | 0.57 |
| ▸ | CTSB | P07858 | 2/20 | 0.57 |
| ▸ | MMP2 | P08253 | 3/20 | 0.54 |
| ▸ | MMP9 | P14780 | 3/20 | 0.54 |
| ▸ | MMP12 | P39900 | 2/20 | 0.54 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.52 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28700690 | 1.00 | ALDH1A1 (0.61) | ALDH1A1LMNASMN1; SMN2HDAC8CTSL | |
| SCHEMBL6183756 | 0.89 | CTSL (0.76) | ALDH1A1LMNASMN1; SMN2CTSLCTSK | |
| SCHEMBL402181 | 0.81 | HDAC8 (0.62) | ALDH1A1LMNASMN1; SMN2HDAC8MMP2 | |
| SCHEMBL8248607 | 0.81 | ALDH1A1 (0.72) | ALDH1A1LMNASMN1; SMN2HDAC8GPR139 | |
| SCHEMBL28690894 | 0.79 | BCL2L1 (0.56) | CTSK | |
| SCHEMBL28690896 | 0.79 | BCL2L1 (0.56) | CTSK | |
| SCHEMBL24283563 | 0.79 | CTSL (0.64) | CTSLCTSKCTSSGPR139 | |
| SCHEMBL24283565 | 0.79 | CTSL (0.64) | CTSLCTSKCTSSGPR139 | |
| SCHEMBL6183715 | 0.78 | CTSL (0.76) | CTSLCTSKCTSSCTSBGPR139 | |
| SCHEMBL8357595 | 0.77 | GPR139 (0.52) | ALDH1A1LMNASMN1; SMN2HDAC8CTSL |
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-114181116-A | D-amino acid derivative aminopeptidase N inhibitor and preparation method and application thereof | 山东中医药大学 | 2022-03-15 | — | — | CN | disclosed |