Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MALT1 | Q9UDY8 | 9/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.68 |
| ▸ | RAB9A | P51151 | 4/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.68 |
| ▸ | LMNA | P02545 | 3/20 | 0.68 |
| ▸ | IDO1 | P14902 | 2/20 | 0.68 |
| ▸ | MEN1 | O00255 | 2/20 | 0.68 |
| ▸ | TDP2 | O95551 | 2/20 | 0.68 |
| ▸ | BLM | P54132 | 2/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.68 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.68 |
| ▸ | TP53 | P04637 | 2/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.68 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.68 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.68 |
| ▸ | MAPT | P10636 | 2/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.68 |
| ▸ | CES2 | O00748 | 1/20 | 0.68 |
| ▸ | GMNN | O75496 | 1/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL14456608 | 0.94 | MALT1 (0.71) | MALT1ALDH1A1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL5940435 | 0.86 | MALT1 (0.75) | MALT1ALDH1A1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL5940140 | 0.83 | MALT1 (0.71) | MALT1ALDH1A1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL5940394 | 0.81 | MALT1 (0.74) | MALT1ALDH1A1RAB9ASMN1; SMN2LMNA | |
| Lapachone SCHEMBL107042 | 0.81 | MALT1 (1.00) | MALT1ALDH1A1RAB9ASMN1; SMN2LMNA | |
| Lapachone SCHEMBL29351050 | 0.81 | MALT1 (1.00) | MALT1ALDH1A1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL14439372 | 0.78 | MALT1 (0.90) | MALT1ALDH1A1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL14439378 | 0.76 | MALT1 (1.00) | MALT1ALDH1A1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL25704068 | 0.74 | MALT1 (0.59) | MALT1ALDH1A1RAB9ASMN1; SMN2LMNA | |
| Alpha-Lapachone SCHEMBL102553 | 0.73 | IDO1 (1.00) | MALT1ALDH1A1RAB9ASMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-4180034-A1 | PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING NAPHTHOQUINONE-BASED COMPOUND AND IMMUNE CHECKPOINT INHIBITOR AS ACTIVE INGREDIENTS | NADIANBIO Ltd. (KR) | 2023-05-17 | — | — | EP | disclosed |