Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.54 |
| ▸ | CXCR4 | P61073 | 10/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | CCR2 | P41597 | 1/20 | 0.50 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22355323 | 1.00 | SIGMAR1 (0.54) | SIGMAR1CXCR4KMT2AMEN1CHRM2 | |
| SCHEMBL22355488 | 0.88 | SIGMAR1 (0.49) | SIGMAR1KMT2AALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL22355319 | 0.85 | SIGMAR1 (0.50) | SIGMAR1CXCR4KMT2AMEN1CHRM2 | |
| SCHEMBL22355301 | 0.79 | MAPT (0.47) | SIGMAR1CXCR4KMT2AMEN1CHRM2 | |
| SCHEMBL10316935 | 0.79 | SIGMAR1 (0.85) | SIGMAR1CXCR4KMT2AMEN1CHRM2 | |
| SCHEMBL255099 | 0.79 | SIGMAR1 (0.85) | SIGMAR1CXCR4KMT2AMEN1CHRM2 | |
| SCHEMBL31616422 | 0.78 | SIGMAR1 (0.82) | SIGMAR1CXCR4KMT2AMEN1CHRM2 | |
| Hydrochloric Acid SCHEMBL7422770 | 0.78 | SIGMAR1 (0.82) | SIGMAR1CXCR4KMT2AMEN1CHRM2 | |
| SCHEMBL22355330 | 0.77 | MAPT (0.42) | CXCR4KMT2AMEN1ALDH1A1 | |
| SCHEMBL22355485 | 0.77 | MAPT (0.47) | CXCR4KMT2AMEN1CHRM2CHRM1 |
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-3377504-B1 | CYCLAM BASED COMPOUNDS, THEIR CONJUGATES, CO-ORDINATION COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, METHOD OF PREPARATION AND USE THEREOF | UNIV KARLOVA (CZ) | 2020-08-19 | — | — | EP | disclosed |