Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | AKT1 | P31749 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CCNC | P24863 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | CASP3 | P42574 | 2/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14899569 | 0.79 | TNF (0.51) | TNFHTTLMNASMN1; SMN2TSHR | |
| SCHEMBL14899564 | 0.79 | TNF (0.45) | TNFHTTLMNASMN1; SMN2TSHR | |
| SCHEMBL19957465 | 0.79 | PARP1 (0.41) | HTTLMNACCNCCDK8CASP3 | |
| SCHEMBL741042 | 0.72 | SLC22A12 (0.53) | TNFHTTLMNASMN1; SMN2TSHR | |
| SCHEMBL1557613 | 0.71 | TNF (0.42) | TNFHTTLMNASMN1; SMN2TSHR | |
| SCHEMBL21190488 | 0.71 | TNF (0.55) | TNFHTTLMNASMN1; SMN2TSHR | |
| SCHEMBL4745808 | 0.71 | EGFR (0.43) | TNFHTTLMNASMN1; SMN2TSHR | |
| SCHEMBL8021772 | 0.68 | HTT (0.57) | HTTLMNASMN1; SMN2ALDH1A1CCNC | |
| SCHEMBL16247955 | 0.68 | SLC22A12 (0.49) | HTTLMNASMN1; SMN2CHEK1PIM1 | |
| SCHEMBL28546764 | 0.68 | HTT (0.53) | HTTLMNASMN1; SMN2CHEK1PIM1 |
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-2998296-B1 | CYCLOALKYL ACID DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL APPLICATION THEREOF | Shanghai hengrui pharmaceutical co ltd (CN) | 2018-03-14 | — | — | EP | disclosed |