Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.44 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10903263 | 0.93 | HDAC1 (0.52) | HDAC1HDAC4KCNH2SMN1; SMN2GAA | |
| SCHEMBL10900440 | 0.82 | EBP (0.51) | HDAC1HDAC4KCNH2MEN1KMT2A | |
| SCHEMBL24673196 | 0.80 | HDAC1 (0.47) | HDAC1HDAC4KCNH2SMN1; SMN2GAA | |
| SCHEMBL24672617 | 0.79 | SIGMAR1 (0.55) | KCNH2SMN1; SMN2LMNAPOLBCYP2D6 | |
| SCHEMBL10074441 | 0.78 | HDAC1 (0.62) | HDAC1HDAC4KCNH2SMN1; SMN2GAA | |
| SCHEMBL10900938 | 0.78 | CHKA (0.60) | HDAC1HDAC4KCNH2SMN1; SMN2GAA | |
| SCHEMBL24462523 | 0.77 | HRH4 (0.54) | HDAC1HDAC6MEN1KMT2AHRH3 | |
| SCHEMBL27486206 | 0.77 | HRH3 (0.66) | HDAC1HDAC4KCNH2SMN1; SMN2GAA | |
| SCHEMBL22014467 | 0.76 | HDAC1 (0.54) | HDAC1HDAC4KCNH2HDAC6ALDH1A1 | |
| SCHEMBL21797152 | 0.76 | KDM4E (0.68) | SMN1; SMN2GAALMNAALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022204065-A1 | IRON(III) MACROCYCLIC COMPLEXES WITH MIXED HYROXYL PENDANTS AS MRI CONTRAST AGENTS | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2022-09-29 | — | — | WO | disclosed |