Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.57 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | MLYCD | O95822 | 5/20 | 0.42 |
| ▸ | ACHE | P22303 | 6/20 | 0.41 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.39 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.39 |
| ▸ | PLOD1 | Q02809 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL30226472 | 0.80 | HCAR2 (0.77) | HCAR2CES1PLOD2PLOD3PLOD1 | |
| SCHEMBL25006960 | 0.79 | HCAR2 (0.57) | HCAR2 | |
| Trifluoroacetic Acid SCHEMBL6386625 | 0.77 | HCAR2 (0.55) | HCAR2PLOD2PLOD3PLOD1 | |
| SCHEMBL21431440 | 0.76 | HCAR2 (0.53) | HCAR2CES1PLOD2PLOD3PLOD1 | |
| SCHEMBL21408730 | 0.76 | PLOD2 (0.67) | HCAR2CES1PLOD2PLOD3PLOD1 | |
| SCHEMBL26907129 | 0.76 | CES1 (0.60) | CES1MLYCDACHEPLOD2PLOD3 | |
| SCHEMBL31522121 | 0.75 | HCAR2 (0.70) | HCAR2 | |
| SCHEMBL5332528 | 0.73 | PLOD2 (0.62) | HCAR2CES1ACHEPLOD2PLOD3 | |
| SCHEMBL29479526 | 0.73 | PLOD2 (0.62) | HCAR2CES1ACHEPLOD2PLOD3 | |
| SCHEMBL9210101 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020057403-A1 | INDOLE DERIVATIVE AND MEDICAL APPLICATION THEREOF | 北京越之康泰生物医药科技有限公司 | 2020-03-26 | — | — | WO | disclosed |