Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.60 |
| ▸ | CCR3 | P51677 | 1/20 | 0.58 |
| ▸ | MC4R | P32245 | 1/20 | 0.56 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | HTR7 | P34969 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10860524 | 0.86 | SIGMAR1 (0.64) | SIGMAR1CCR3MC4RHTR2AHTR7 | |
| SCHEMBL13460805 | 0.82 | SMN1; SMN2 (0.58) | SIGMAR1CCR3MC4RHTR2AHTR7 | |
| Hydrochloric Acid SCHEMBL11384744 | 0.82 | CCR3 (0.61) | SIGMAR1CCR3MC4RHTR2AHTR7 | |
| SCHEMBL544347 | 0.81 | SIGMAR1 (0.74) | SIGMAR1CCR3MC4R | |
| SCHEMBL249489 | 0.80 | SIGMAR1 (0.72) | SIGMAR1CCR3MC4RPOLBKMT2A | |
| SCHEMBL7608951 | 0.80 | ALDH1A1 (0.56) | SIGMAR1CCR3HTR2AHTR7KDM4E | |
| SCHEMBL6657455 | 0.80 | CCR3 (0.85) | SIGMAR1CCR3MC4RPOLBDRD4 | |
| SCHEMBL6659913 | 0.80 | CCR3 (0.79) | SIGMAR1CCR3MC4RKDM4EALDH1A1 | |
| SCHEMBL6659339 | 0.80 | SIGMAR1 (0.86) | SIGMAR1CCR3MC4RPOLBKMT2A | |
| SCHEMBL7604178 | 0.80 | HRH1 (0.60) | SIGMAR1CCR3MC4RHTR2AHTR7 |
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-2393794-B1 | DESIGN, SYNTHESIS AND EVALUATION OF PROCASPASE ACTIVATING COMPOUNDS AS PERSONALIZED ANTI-CANCER DRUGS | UNIV ILLINOIS (US) | 2017-03-22 | — | — | EP | disclosed |