Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24672262 | 0.94 | POLB (0.38) | LMNAMAPK1HTTPOLBPKM | |
| SCHEMBL24673208 | 0.81 | KDM4E (0.31) | POLB | |
| SCHEMBL24673209 | 0.81 | PGK1 (0.41) | LMNAHDAC4HDAC1KCNH2CACNA1G | |
| SCHEMBL24672258 | 0.80 | KDM4E (0.51) | LMNAHTTPOLBHDAC4HDAC1 | |
| SCHEMBL24673196 | 0.80 | HDAC1 (0.47) | LMNAHDAC4HDAC1KCNH2APOBEC3A | |
| SCHEMBL24673200 | 0.78 | PKM (0.43) | PKMAPOBEC3ARECQLAPOBEC3GKMT2A | |
| SCHEMBL24673213 | 0.76 | PGK1 (0.45) | HTTPOLBPKMHDAC4HDAC1 | |
| SCHEMBL24673252 | 0.74 | DRD2 (0.32) | POLBMAPT | |
| SCHEMBL24673327 | 0.73 | POLB (0.53) | LMNAMAPK1POLBKMT2ASMN1; SMN2 | |
| SCHEMBL24673250 | 0.71 | SIGMAR1 (0.56) | LMNAPOLBAPOBEC3ARECQLAPOBEC3G |
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 |