Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2917080 | 1.00 | HSD17B10 (0.49) | HSD17B10LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL2913442 | 1.00 | HSD17B10 (0.49) | HSD17B10LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL2917078 | 1.00 | HSD17B10 (0.49) | HSD17B10LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL2913444 | 1.00 | HSD17B10 (0.49) | HSD17B10LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL15731577 | 0.90 | CHRM2 (0.45) | HSD17B10LMNANPSR1SMN1; SMN2CHRM2 | |
| SCHEMBL31153617 | 0.90 | CHRM2 (0.45) | HSD17B10LMNANPSR1SMN1; SMN2CHRM2 | |
| SCHEMBL29222095 | 0.90 | CHRM2 (0.45) | HSD17B10LMNANPSR1SMN1; SMN2CHRM2 | |
| SCHEMBL4468362 | 0.90 | CHRM2 (0.45) | HSD17B10LMNANPSR1SMN1; SMN2CHRM2 | |
| SCHEMBL20514898 | 0.90 | CHRM2 (0.45) | HSD17B10LMNANPSR1SMN1; SMN2CHRM2 | |
| SCHEMBL2198040 | 0.90 | CHRM2 (0.45) | HSD17B10LMNANPSR1SMN1; SMN2CHRM2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2010506-B1 | DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | HOFFMANN LA ROCHE (CH) | 2010-08-04 | — | — | EP | disclosed |
| US-7632829-B2 | Diazepan derivatives | HOFFMANN-LA ROCHE INC. (US) | 2009-12-15 | — | — | US | disclosed |
| EP-2010506-A1 | DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | F. Hoffmann-Roche AG (CH) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007122103-A1 | DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-11-01 | — | — | WO | disclosed |