Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 8/20 | 0.61 |
| ▸ | CCR5 | P51681 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 3/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA3 | P07451 | 1/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.49 |
| ▸ | CA6 | P23280 | 1/20 | 0.49 |
| ▸ | CA5A | P35218 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.49 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14975115 | 1.00 | GBA1 (0.61) | GBA1CCR5KMT2AMEN1LMNA | |
| SCHEMBL14975116 | 1.00 | GBA1 (0.61) | GBA1CCR5KMT2AMEN1LMNA | |
| SCHEMBL28088541 | 0.88 | CA9 (0.48) | GBA1KMT2AMEN1LMNAMAPT | |
| SCHEMBL28088542 | 0.88 | CA9 (0.48) | GBA1KMT2AMEN1LMNAMAPT | |
| SCHEMBL14975124 | 0.87 | GBA1 (0.47) | GBA1CCR5KMT2AMEN1LMNA | |
| SCHEMBL14974422 | 0.87 | GBA1 (0.55) | GBA1KMT2AMEN1LMNAMAPT | |
| Hydrochloric Acid SCHEMBL15758003 | 0.87 | CA9 (0.47) | GBA1KMT2AMEN1LMNAMAPT | |
| Hydrochloric Acid SCHEMBL15758006 | 0.87 | CA9 (0.47) | GBA1KMT2AMEN1LMNAMAPT | |
| SCHEMBL14974421 | 0.87 | GBA1 (0.55) | GBA1KMT2AMEN1LMNAMAPT | |
| SCHEMBL14975122 | 0.87 | GBA1 (0.47) | GBA1CCR5KMT2AMEN1LMNA |
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-2598492-A1 | BICYCLIC AZAHETEROCYCLIC CARBOXAMIDES AS INHIBITORS OF THE KINASE P70S6K | Merck Patent GmbH (DE) | 2013-06-05 | — | — | EP | disclosed |
| WO-2012013282-A1 | BICYCLIC AZAHETEROCYCLIC CARBOXAMIDES AS INHIBITORS OF THE KINASE P70S6K | MERCK PATENT GMBH (DE) | 2012-02-02 | — | — | WO | disclosed |