Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 20/20 | 0.65 |
| ▸ | IP6K2 | Q9UHH9 | 18/20 | 0.65 |
| ▸ | IP6K3 | Q96PC2 | 17/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL30967424 | 0.88 | IP6K1 (0.63) | IP6K1IP6K2IP6K3ALDH1A1LMNA | |
| SCHEMBL30967412 | 0.88 | IP6K1 (0.75) | IP6K1IP6K2IP6K3ALDH1A1LMNA | |
| SCHEMBL30967421 | 0.84 | IP6K1 (0.64) | IP6K1IP6K2IP6K3ALDH1A1LMNA | |
| SCHEMBL30967422 | 0.83 | IP6K1 (0.57) | IP6K1IP6K2IP6K3ALDH1A1LMNA | |
| SCHEMBL30967418 | 0.81 | IP6K1 (0.57) | IP6K1IP6K2IP6K3ALDH1A1LMNA | |
| SCHEMBL30967416 | 0.81 | IP6K1 (0.66) | IP6K1IP6K2IP6K3ALDH1A1LMNA | |
| SCHEMBL30967417 | 0.80 | IP6K1 (0.56) | IP6K1IP6K2IP6K3ALDH1A1LMNA | |
| SCHEMBL30967419 | 0.80 | IP6K1 (0.56) | IP6K1IP6K2IP6K3ALDH1A1LMNA | |
| SCHEMBL30967425 | 0.79 | IP6K1 (0.58) | IP6K1IP6K2IP6K3ALDH1A1LMNA | |
| SCHEMBL30967410 | 0.79 | IP6K1 (1.00) | IP6K1IP6K2IP6K3ALDH1A1LMNA |
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-118459418-B | Hydroxamic acid HDAC inhibitor and application thereof in preparation of antitumor drugs | 河北中医药大学 | 2025-04-08 | — | — | CN | disclosed |
| CN-118459418-A | Hydroxamic acid HDAC inhibitor and application thereof in preparation of antitumor drugs | 河北中医药大学 | 2024-08-09 | — | — | CN | disclosed |