Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.72 |
| ▸ | CXCR4 | P61073 | 8/20 | 0.67 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.61 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.61 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.61 |
| ▸ | CCR2 | P41597 | 1/20 | 0.61 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.61 |
| ▸ | BLM | P54132 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL27300143 | 0.95 | SIGMAR1 (0.77) | SIGMAR1CXCR4HRH3MEN1KMT2A | |
| SCHEMBL6632216 | 0.95 | SIGMAR1 (0.82) | SIGMAR1CXCR4HRH3MEN1KMT2A | |
| SCHEMBL3779720 | 0.92 | CXCR4 (0.78) | SIGMAR1CXCR4HRH3MEN1KMT2A | |
| SCHEMBL15046526 | 0.91 | CXCR4 (0.75) | SIGMAR1CXCR4HRH3MEN1KMT2A | |
| SCHEMBL255099 | 0.89 | SIGMAR1 (0.85) | SIGMAR1CXCR4HRH3MEN1KMT2A | |
| SCHEMBL3999326 | 0.89 | CXCR4 (0.79) | SIGMAR1CXCR4HRH3MEN1KMT2A | |
| SCHEMBL10316935 | 0.89 | SIGMAR1 (0.85) | SIGMAR1CXCR4HRH3MEN1KMT2A | |
| SCHEMBL8327 | 0.88 | SIGMAR1 (0.77) | SIGMAR1HRH3TDP1ALDH1A1CYP2C19 | |
| SCHEMBL11585348 | 0.88 | SIGMAR1 (0.77) | SIGMAR1HRH3TDP1ALDH1A1CYP2C19 | |
| SCHEMBL11141692 | 0.88 | SIGMAR1 (0.77) | SIGMAR1HRH3TDP1ALDH1A1CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2892892-A1 | IMIDAZOLIN-5-ONE DERIVATIVES USEFUL AS FATTY ACID SNTHASE (FASN) INHIBITORS FOR!THE TREATMENT OF CANCER | Janssen Pharmaceutica N.V. (BE) | 2015-07-15 | — | — | EP | disclosed |
| WO-2014039769-A1 | IMIDAZOLIN-5-ONE DERIVATIVES USEFUL AS FATTY ACID SNTHASE (FASN) INHIBITORS FOR|THE TREATMENT OF CANCER | JANSSEN PHARMACEUTICA NV (BE) | 2014-03-13 | — | — | WO | disclosed |