Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22987635 | 0.79 | CYP2C19 (0.49) | SMN1; SMN2TP53USP2ALDH1A1TSHR | |
| SCHEMBL22987821 | 0.77 | PTGS1 (0.52) | USP2ALDH1A1MAPTTSHRKMT2A | |
| SCHEMBL9497739 | 0.77 | PTGS1 (0.52) | USP2ALDH1A1MAPTTSHRKMT2A | |
| Hydrochloric Acid SCHEMBL29646318 | 0.76 | PTGS1 (0.50) | USP2ALDH1A1MAPTKMT2A | |
| SCHEMBL14520631 | 0.76 | USP2 (0.59) | SMN1; SMN2TP53USP2ALDH1A1LMNA | |
| SCHEMBL30392344 | 0.76 | CA12 (0.51) | ALDH1A1KDM4EKMT2A | |
| SCHEMBL18420922 | 0.75 | SMN1; SMN2 (0.54) | SMN1; SMN2TP53USP2ALDH1A1LMNA | |
| SCHEMBL18421094 | 0.74 | SMN1; SMN2 (0.52) | SMN1; SMN2TP53USP2ALDH1A1LMNA | |
| SCHEMBL12017899 | 0.73 | SMN1; SMN2 (0.56) | SMN1; SMN2TP53USP2ALDH1A1LMNA | |
| SCHEMBL14738671 | 0.73 | — | — |
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-2063887-B1 | NEW SMALL MOLECULE INHIBITORS OF MDM2 AND THE USES THEREOF | UNIV MICHIGAN (US) | 2013-05-29 | — | — | EP | disclosed |