Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.66 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.66 |
| ▸ | TMEM97 | Q5BJF2 | 6/20 | 0.64 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.64 |
| ▸ | HTR1A | P08908 | 1/20 | 0.64 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.64 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.64 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.64 |
| ▸ | DRD1 | P21728 | 1/20 | 0.64 |
| ▸ | HRH2 | P25021 | 1/20 | 0.64 |
| ▸ | HTR1B | P28222 | 1/20 | 0.64 |
| ▸ | HTR2A | P28223 | 1/20 | 0.64 |
| ▸ | HTR2C | P28335 | 1/20 | 0.64 |
| ▸ | HTR1E | P28566 | 1/20 | 0.64 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.64 |
| ▸ | HRH1 | P35367 | 1/20 | 0.64 |
| ▸ | HTR2B | P41595 | 1/20 | 0.64 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL2607031 | 1.00 | MEN1 (0.66) | MEN1KMT2ANPSR1TMEM97SIGMAR1 | |
| SCHEMBL24091701 | 0.94 | TMEM97 (0.60) | MEN1KMT2ANPSR1TMEM97SIGMAR1 | |
| SCHEMBL379160 | 0.92 | MEN1 (0.76) | MEN1KMT2ANPSR1HTR2CSMN1; SMN2 | |
| SCHEMBL7393652 | 0.92 | MEN1 (0.76) | MEN1KMT2ANPSR1HTR2CSMN1; SMN2 | |
| SCHEMBL3970912 | 0.92 | MEN1 (0.76) | MEN1KMT2ANPSR1HTR2CSMN1; SMN2 | |
| SCHEMBL4814264 | 0.92 | MEN1 (0.76) | MEN1KMT2ANPSR1HTR2CSMN1; SMN2 | |
| SCHEMBL5308873 | 0.90 | CYP2C19 (0.57) | MEN1KMT2ANPSR1TMEM97SIGMAR1 | |
| SCHEMBL22014628 | 0.90 | MEN1 (0.80) | MEN1KMT2ANPSR1TMEM97SIGMAR1 | |
| SCHEMBL15011579 | 0.90 | MEN1 (0.73) | MEN1KMT2ANPSR1HTR2CSMN1; SMN2 | |
| Bicarbonate SCHEMBL4357688 | 0.90 | MEN1 (0.73) | MEN1KMT2ANPSR1HTR2CSMN1; SMN2 |
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 |