Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 3/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | F2R | P25116 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | DUT | P33316 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13737735 | 0.87 | DGAT1 (0.34) | DGAT1HSP90AA1NPC1HDAC1CDK1 | |
| SCHEMBL13738818 | 0.81 | PRMT5 (0.40) | DGAT1 | |
| SCHEMBL29407693 | 0.81 | PRMT5 (0.40) | DGAT1 | |
| SCHEMBL30542276 | 0.78 | DGAT1 (0.40) | DGAT1NPC1DUT | |
| SCHEMBL1291499 | 0.77 | HDAC1 (0.38) | DGAT1HDAC6HSP90AA1NPC1HDAC4 | |
| SCHEMBL2884544 | 0.76 | DGAT1 (0.35) | DGAT1NPC1DUT | |
| SCHEMBL30041757 | 0.76 | PNP (0.38) | HSP90AA1ADORA2AADORA1 | |
| SCHEMBL13906311 | 0.75 | DGAT1 (0.34) | DGAT1NPC1 | |
| SCHEMBL31497497 | 0.75 | DGAT1 (0.37) | DGAT1NPC1HDAC1DUT | |
| SCHEMBL31410899 | 0.75 | DGAT1 (0.34) | DGAT1NPC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4217348-A1 | INDOLINE COMPOUNDS AND DERIVATIVES AS EGFR INHIBITORS | BeiGene, Ltd. (KY) | 2023-08-02 | — | — | EP | disclosed |
| CN-116249690-A | Indoline compounds and derivatives as EGFR inhibitors | 百济神州有限公司 | 2023-06-09 | — | — | CN | disclosed |
| CN-115279373-A | Cyanopyrimidine inhibitors of EGFR/HER2 | 达纳-法伯癌症研究所股份有限公司 | 2022-11-01 | — | — | CN | disclosed |
| WO-2022062601-A1 | PYRIMIDOPYRROLE COMPOUND | 江苏先声药业有限公司 | 2022-03-31 | — | — | WO | disclosed |
| WO-2022063106-A1 | INDOLINE COMPOUNDS AND DERIVATIVES AS EGFR INHIBITORS | BEIGENE, LTD. (KY) | 2022-03-31 | — | — | WO | disclosed |