Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH2 | P48735 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | UBE2M | P61081 | 1/20 | 0.48 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | HTT | P42858 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.47 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 3/20 | 0.47 |
| ▸ | IDH1 | O75874 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.46 |
| ▸ | GRIK1 | P39086 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28876142 | 0.77 | IDH2 (0.66) | IDH2MEN1KMT2AUBE2MDCUN1D1 | |
| SCHEMBL6370948 | 0.71 | TRPV1 (0.64) | IDH2MEN1KMT2AMAPTHTT | |
| SCHEMBL30101230 | 0.71 | KMT2A (0.90) | MEN1KMT2AMAPTHTTRAB9A | |
| SCHEMBL5597699 | 0.71 | KMT2A (0.90) | MEN1KMT2AMAPTHTTRAB9A | |
| SCHEMBL15646848 | 0.71 | IDH2 (1.00) | IDH2MEN1KMT2AMAPTHTT | |
| SCHEMBL17664319 | 0.70 | KMT2A (0.82) | MEN1KMT2AMAPTHTTRAB9A | |
| SCHEMBL4548162 | 0.69 | KMT2A (0.87) | MEN1KMT2AMAPTHTTRAB9A | |
| SCHEMBL13853021 | 0.69 | PTGER3 (0.59) | IDH2MEN1KMT2AMAPTHTT | |
| SCHEMBL13193498 | 0.69 | PTGER3 (0.59) | IDH2MEN1KMT2AMAPTHTT | |
| SCHEMBL3429585 | 0.68 | MAPT (0.68) | MEN1KMT2AUBE2MDCUN1D1MAPT |
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-106810512-B | IDH2 mutant inhibitor and application thereof | 江苏省中医药研究院 | 2019-09-10 | — | — | CN | disclosed |