Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 6/20 | 0.70 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NQO1 | P15559 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30504578 | 1.00 | EGFR (0.70) | EGFRCYP11B1CYP11B2CYP19A1MAPT | |
| SCHEMBL28243443 | 0.86 | EGFR (0.70) | EGFRCYP11B1CYP11B2CYP19A1MAPT | |
| SCHEMBL668493 | 0.82 | EGFR (1.00) | EGFRCYP11B1CYP11B2LMNAALDH1A1 | |
| SCHEMBL29517021 | 0.82 | EGFR (1.00) | EGFRCYP11B1CYP11B2LMNAALDH1A1 | |
| SCHEMBL30241125 | 0.82 | EGFR (1.00) | EGFRCYP11B1CYP11B2LMNAALDH1A1 | |
| SCHEMBL2637564 | 0.82 | EGFR (0.69) | EGFRHDAC1HDAC6HDAC5PDGFRB | |
| SCHEMBL13837704 | 0.82 | EGFR (0.73) | EGFRTSHRHSD17B10HDAC1HDAC6 | |
| Hydrochloric Acid SCHEMBL28023744 | 0.81 | EGFR (0.96) | EGFRCYP11B1CYP11B2LMNAALDH1A1 | |
| SCHEMBL7580057 | 0.80 | EGFR (0.60) | EGFRLMNAHDAC1HDAC6HDAC5 | |
| SCHEMBL29831918 | 0.79 | EGFR (0.59) | EGFRCYP3A4TSHRNCF1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104069112-A | Substituted piperidino-dihydrothienopyrimidines | BOEHRINGER INGELHEIM INT | 2014-10-01 | — | — | CN | disclosed |
| EP-1962960-A1 | MICRONIZATION METHOD | Boehringer Ingelheim Pharma GmbH & Co.KG (DE) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007068655-A1 | MICRONIZATION METHOD | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2007-06-21 | — | — | WO | disclosed |