Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 5/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.43 |
| ▸ | CDK9 | P50750 | 2/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.42 |
| ▸ | GHSR | Q92847 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | MGAT2 | Q10469 | 1/20 | 0.38 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | STS | P08842 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL22010912 | 1.00 | BTK (0.44) | BTKCCNT1CDK9MTNR1AMTNR1B | |
| SCHEMBL22010906 | 0.90 | BTK (0.52) | BTKCCNT1CDK9GPR119 | |
| SCHEMBL30161685 | 0.90 | BTK (0.52) | BTKCCNT1CDK9GPR119 | |
| SCHEMBL22010486 | 0.87 | BTK (0.42) | BTKCCNT1CDK9GPR119BACE1 | |
| SCHEMBL22010505 | 0.87 | BTK (0.42) | BTKCCNT1CDK9GPR119BACE1 | |
| SCHEMBL22010483 | 0.84 | BTK (0.45) | BTKCCNT1CDK9GPR119POLB | |
| SCHEMBL22010736 | 0.84 | BTK (0.45) | BTKCCNT1CDK9GPR119POLB | |
| SCHEMBL22010485 | 0.84 | BTK (0.45) | BTKCCNT1CDK9GPR119POLB | |
| SCHEMBL22010468 | 0.84 | BTK (0.47) | BTKCCNT1CDK9GPR119 | |
| SCHEMBL22010469 | 0.84 | BTK (0.47) | BTKCCNT1CDK9GPR119 |
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-2020099341-A1 | ANTIBIOTIC COMPOUNDS, METHODS OF MANUFACTURING THE SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES THEREOF | DEBIOPHARM INTERNATIONAL S.A. (CH) | 2020-05-22 | — | — | WO | disclosed |