Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | GRK2 | P25098 | 7/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.44 |
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NLRP1 | Q9C000 | 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 | |
|---|---|---|---|---|
| SCHEMBL24137901 | 0.82 | LMNA (0.51) | GAAGRK2ROCK2RAB9AALDH1A1 | |
| SCHEMBL19634841 | 0.82 | NOTUM (0.53) | RAB9ASMN1; SMN2ALDH1A1KMT2A | |
| SCHEMBL20389264 | 0.80 | GAA (0.49) | GAAGRK2ROCK2FDPSMDM2 | |
| SCHEMBL2605750 | 0.79 | BCHE (0.53) | NAMPTMDM2BCHERAB9ASMN1; SMN2 | |
| SCHEMBL13588776 | 0.79 | FDPS (0.46) | GAAGRK2ROCK2FDPSMDM2 | |
| SCHEMBL6510629 | 0.77 | ALDH1A1 (0.59) | GAAROCK2RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL14279030 | 0.77 | ALDH1A1 (0.50) | GAANAMPTRAB9AALDH1A1MAPT | |
| SCHEMBL9911486 | 0.77 | KMT2A (0.40) | GAARAB9AALDH1A1MAPTKMT2A | |
| SCHEMBL13589463 | 0.76 | MDM2 (0.48) | GAAGRK2ROCK2FDPSMDM2 | |
| SCHEMBL11481061 | 0.75 | MDM2 (0.52) | GAAGRK2ROCK2FDPSMDM2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8198458-B2 | Non-nucleoside reverse transcriptase inhibitors | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-06-12 | — | — | US | disclosed |