Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SGK1 | O00141 | 1/20 | 0.44 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.44 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.42 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.42 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL20733015 | 0.85 | SGK1 (0.46) | SGK1CAMKK2MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL20733083 | 0.78 | HPGD (0.59) | KDM4EALDH1A1HPGDGAA | |
| SCHEMBL4728311 | 0.78 | ABL1 (0.50) | SGK1CAMKK2MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL16549247 | 0.76 | MAPT (0.50) | SGK1CAMKK2MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL20733016 | 0.74 | MELK (0.42) | SGK1CAMKK2SLC2A1EGFRHPGD | |
| SCHEMBL10138348 | 0.73 | SLC22A12 (0.51) | SGK1CAMKK2MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL38655748 | 0.71 | MAP2K4 (0.48) | MAPTRAB9ASMN1; SMN2TP53SLC2A1 | |
| SCHEMBL20733012 | 0.71 | CCNC (0.52) | — | |
| SCHEMBL30436770 | 0.70 | MAPT (0.51) | MAPTRAB9ASMN1; SMN2TP53IKBKE | |
| SCHEMBL595530 | 0.70 | MAPT (0.51) | MAPTRAB9ASMN1; SMN2TP53IKBKE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3666770-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS CDK8/19 INHIBITORS | Joint Stock Company "Biocad" (RU) | 2020-06-17 | — | — | EP | disclosed |
| WO-2019031990-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS CDK8/19 INHIBITORS | ЗАКРЫТОЕ АКЦИОНЕРНОЕ ОБЩЕСТВО "БИОКАД" | 2019-02-14 | — | — | WO | disclosed |