Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| SCHEMBL7790314 | 0.86 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPTHIF1AADAMTS5 | |
| SCHEMBL7790836 | 0.79 | ITGB3 (0.46) | ALDH1A1KDM4EMAPTHIF1ALMNA | |
| SCHEMBL7790329 | 0.77 | MAPT (0.50) | ALDH1A1KDM4EMAPTHIF1ALMNA | |
| SCHEMBL7787452 | 0.76 | KDM4E (0.46) | ALDH1A1KDM4EMAPTLMNANPSR1 | |
| SCHEMBL7790323 | 0.72 | MAPT (0.52) | ALDH1A1KDM4EMAPTHIF1ALMNA | |
| SCHEMBL7790305 | 0.71 | ITGB3 (0.47) | ALDH1A1KDM4E | |
| SCHEMBL7790309 | 0.71 | ITGB3 (0.57) | ALDH1A1KDM4EMAPTHIF1ALMNA | |
| SCHEMBL8355447 | 0.70 | POLB (0.38) | ALDH1A1KDM4EMAPTHIF1AADAMTS5 | |
| SCHEMBL7787422 | 0.70 | TDP1 (0.49) | ALDH1A1MAPTKMT2A | |
| SCHEMBL7791932 | 0.68 | ITGB3 (0.52) | ALDH1A1KDM4EMAPTHIF1AMMP2 |
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-0808311-A2 | NEW DERIVATIVES OF PYRIDIL PIPERAZINE OR PYRIDAZINYL PIPERAZYL, PROCESS FOR PRODUCTION THEREOF AND MEDICAMENTS CONTAINING THESE COMPOUNDS | Roche Diagnostics GmbH (DE) | 1997-11-26 | — | — | EP | disclosed |
| WO-1996024581-A2 | DERIVATIVES OF PYRIDIL PIPERAZINE OR PYRIDAZINYL PIPERAZYL, PROCESS FOR PRODUCTION THEREOF AND MEDICAMENTS CONTAINING THESE COMPOUNDS | BOEHRINGER MANNHEIM GMBH (DE) | 1996-08-15 | — | — | WO | disclosed |