Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 8/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10382447 | 0.81 | SMN1; SMN2 (0.36) | SMN1; SMN2KDM4EMITFLMNAPOLB | |
| SCHEMBL6723346 | 0.79 | MAOA (0.36) | SMN1; SMN2KDM4EMITFLMNAPOLB | |
| SCHEMBL1820342 | 0.76 | PTPN1 (0.36) | SMN1; SMN2KDM4EMITFLMNAPOLB | |
| SCHEMBL6171978 | 0.76 | PARP1 (0.36) | TSHRNISCHMAOB | |
| SCHEMBL25273343 | 0.74 | NPC1 (0.33) | MAPK1 | |
| SCHEMBL10192535 | 0.74 | MAOA (0.37) | SMN1; SMN2KDM4EMITFLMNAPOLB | |
| SCHEMBL28330440 | 0.73 | TSHR (0.36) | SMN1; SMN2KDM4EMITFLMNAPOLB | |
| SCHEMBL787684 | 0.72 | CREBBP (0.32) | SMN1; SMN2KDM4EMITFLMNAPOLB | |
| SCHEMBL16797653 | 0.71 | CREBBP (0.36) | SMN1; SMN2KDM4EMITFLMNAPOLB | |
| SCHEMBL3310654 | 0.70 | MGAM (0.47) | KDM4EMAOAMAOBPTPN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023102747-A1 | ANTIMALARIAL AGENTS | MERCK SHARP & DOHME LLC (US) | 2023-06-15 | — | — | WO | disclosed |
| EP-4013742-A1 | ANTIMALARIAL AGENTS | Merck Sharp & Dohme Corp. (US) | 2022-06-22 | — | — | EP | disclosed |
| WO-2021026884-A1 | ANTIMALARIAL AGENTS | MERCK SHARP & DOHME CORP. (US) | 2021-02-18 | — | — | WO | disclosed |
| WO-2021027502-A1 | ANTIMALARIAL AGENTS | MERCK SHARP & DOHME CORP. (US) | 2021-02-18 | — | — | WO | disclosed |