Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 6/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | AGXT | P21549 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL8604263 | 0.83 | SMN1; SMN2 (0.63) | SMN1; SMN2HTTPARP10RAB9AASAH1 | |
| SCHEMBL15759570 | 0.81 | MTNR1A (0.49) | SMN1; SMN2HTTIDO1AGXTALDH1A1 | |
| SCHEMBL13539587 | 0.79 | SMN1; SMN2 (0.42) | SMN1; SMN2RAB9AASAH1LMNAALDH1A1 | |
| SCHEMBL24812942 | 0.78 | IDO1 (0.47) | SMN1; SMN2HTTRAB9ALMNAIDO1 | |
| SCHEMBL14893159 | 0.78 | HPGD (0.60) | SMN1; SMN2RAB9ALMNACA2ALDH1A1 | |
| SCHEMBL31483051 | 0.77 | SMN1; SMN2 (0.53) | SMN1; SMN2HTTMAOBPARP10RAB9A | |
| SCHEMBL5728578 | 0.74 | TAAR1 (0.57) | SMN1; SMN2MAOBRAB9ALMNAIDO1 | |
| SCHEMBL5279148 | 0.74 | MAOB (0.51) | MAOBPARP10IDO1AGXTALDH1A1 | |
| SCHEMBL689542 | 0.73 | CYP2C19 (0.66) | HTTMAOBRAB9ALMNACA2 | |
| Hydroxyamine SCHEMBL8923579 | 0.72 | IDO1 (0.62) | MAOBPARP10IDO1AGXTCA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105050598-A | Novel compounds as ERK inhibitors | MERCK SHARP & DOHME | 2015-11-11 | — | — | CN | disclosed |