Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.37 |
| ▸ | CPT2 | P23786 | 1/20 | 0.34 |
| ▸ | ACLY | P53396 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PGD | P52209 | 1/20 | 0.32 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL606621 | 1.00 | DGAT1 (0.37) | DGAT1CPT2ACLYSRCKCNN4 | |
| SCHEMBL28550395 | 1.00 | DGAT1 (0.37) | DGAT1CPT2ACLYSRCKCNN4 | |
| SCHEMBL28948555 | 0.77 | MMP8 (0.40) | CPT2ACLYALDH1A1TSHR | |
| SCHEMBL20959675 | 0.76 | DGAT1 (0.39) | DGAT1SRCKCNN4ALDH1A1 | |
| SCHEMBL15441365 | 0.75 | TSHR (0.45) | CPT2ACLYTP53ALDH1A1TSHR | |
| SCHEMBL7290475 | 0.75 | TSHR (0.45) | CPT2ACLYTP53ALDH1A1TSHR | |
| SCHEMBL15739248 | 0.75 | TSHR (0.45) | CPT2ACLYTP53ALDH1A1TSHR | |
| SCHEMBL7197080 | 0.75 | DGAT1 (0.48) | DGAT1SRCKCNN4ALDH1A1TSHR | |
| SCHEMBL7291830 | 0.75 | TSHR (0.45) | CPT2ACLYTP53ALDH1A1TSHR | |
| SCHEMBL721782 | 0.75 | TSHR (0.45) | CPT2ACLYTP53ALDH1A1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3168215-B1 | PROCESS FOR PREPARATION OF BARNIDIPINE | USV PRIVATE LTD (IN) | 2020-05-20 | — | — | EP | disclosed |
| EP-3168215-A2 | PROCESS FOR PREPARATION OF BARNIDIPINE | USV Private Limited (IN) | 2017-05-17 | — | — | EP | disclosed |