Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | RECQL | P46063 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29943098 | 1.00 | MPO (0.38) | MPOMEN1KMT2AATMKDM4E | |
| SCHEMBL24672851 | 0.92 | MC4R (0.35) | MEN1KMT2AATMRECQLAPOBEC3A | |
| SCHEMBL24672676 | 0.80 | MPO (0.63) | MPOMEN1KMT2AATMKDM4E | |
| SCHEMBL24672677 | 0.80 | MPO (0.63) | MPOMEN1KMT2AATMKDM4E | |
| SCHEMBL24672239 | 0.76 | MPO (0.41) | MPOMEN1KMT2AKDM4ETDP1 | |
| SCHEMBL24673250 | 0.76 | SIGMAR1 (0.56) | MEN1KMT2AATMKDM4EALDH1A1 | |
| SCHEMBL24673201 | 0.73 | MPO (0.52) | MPOMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL28532123 | 0.73 | CYP2A13 (0.55) | MPOMEN1KMT2AKDM4ETDP1 | |
| SCHEMBL24673337 | 0.72 | LMNA (0.53) | MPOMEN1KMT2ATDP1 | |
| SCHEMBL24673260 | 0.69 | APOBEC3A (0.51) | MEN1KMT2AATMKDM4EALDH1A1 |
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 |