Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | CCR2 | P41597 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL23014409 | 0.84 | ALDH1A1 (0.73) | HDAC1ALDH1A1NPC1RAB9AKMT2A | |
| SCHEMBL23014159 | 0.81 | ALDH1A1 (0.57) | HDAC1HDAC4KCNH2ALDH1A1MEN1 | |
| SCHEMBL23014311 | 0.81 | L3MBTL1 (0.53) | HDAC1HDAC4KCNH2ALDH1A1NPC1 | |
| SCHEMBL23014510 | 0.81 | P2RY12 (0.53) | HDAC1HDAC4KCNH2ALDH1A1KMT2A | |
| SCHEMBL23014235 | 0.80 | HTR1A (0.58) | HDAC1HDAC4KCNH2NPC1RAB9A | |
| SCHEMBL23014236 | 0.79 | KDM4E (0.56) | HDAC1HDAC4KCNH2ALDH1A1CCR2 | |
| SCHEMBL30388111 | 0.79 | SMN1; SMN2 (0.69) | HDAC1ALDH1A1RAB9AMEN1KMT2A | |
| SCHEMBL23014335 | 0.79 | SMN1; SMN2 (0.69) | HDAC1ALDH1A1RAB9AMEN1KMT2A | |
| SCHEMBL29275413 | 0.79 | HDAC4 (0.55) | HDAC1HDAC4KCNH2ALDH1A1HDAC6 | |
| SCHEMBL23014404 | 0.78 | MBTD1 (0.58) | HDAC1HDAC4KCNH2CCR2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4019495-A1 | NOVEL COMPOUND HAVING CANCER METASTASIS INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR INHIBITING CANCER METASTASIS AND INVASION OR TREATING COLORECTAL CANCER, COMPRISING COMPOUND | Cellgentek Co., Ltd (KR) | 2022-06-29 | — | — | EP | disclosed |