Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CTSL | P07711 | 1/20 | 0.50 |
| ▸ | CTSS | P25774 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | TACR1 | P25103 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1464024 | 0.92 | ATM (0.52) | CASP1ALDH1A1CTRB1CYP1A2CTSL | |
| SCHEMBL1463350 | 0.86 | CTRB1 (0.52) | CASP1ALDH1A1CTRB1CYP1A2CTSL | |
| SCHEMBL16201456 | 0.86 | CTRB1 (0.52) | CASP1ALDH1A1CTRB1CYP1A2CTSL | |
| SCHEMBL639236 | 0.85 | TP53 (0.50) | CASP1ALDH1A1POLB | |
| SCHEMBL10976358 | 0.85 | ALDH1A1 (0.47) | CASP1ALDH1A1CTRB1CYP1A2CTSL | |
| SCHEMBL7134978 | 0.82 | CTRB1 (0.55) | CASP1ALDH1A1CTRB1CYP1A2CTSL | |
| SCHEMBL4665558 | 0.82 | CTRB1 (0.55) | CASP1ALDH1A1CTRB1CYP1A2CTSL | |
| SCHEMBL4998172 | 0.82 | CTRB1 (0.55) | CASP1ALDH1A1CTRB1CYP1A2CTSL | |
| SCHEMBL1463820 | 0.82 | ALDH1A1 (0.49) | CASP1ALDH1A1CTRB1CYP1A2CTSL | |
| SCHEMBL917102 | 0.82 | CCKBR (0.49) | ALDH1A1POLB |
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-1021405-A1 | AZETIDINONE DERIVATIVES FOR THE TREATMENT OF HCMV INFECTIONS | BOEHRINGER INGELHEIM (CANADA) LTD. (CA) | 2000-07-26 | — | — | EP | disclosed |
| WO-1999018072-A1 | AZETIDINONE DERIVATIVES FOR THE TREATMENT OF HCMV INFECTIONS | BOEHRINGER INGELHEIM (CANADA) LTD. (CA) | 1999-04-15 | — | — | WO | disclosed |