Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.48 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.48 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.40 |
| ▸ | PDE5A | O76074 | 7/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14474620 | 0.86 | PDE5A (0.43) | PDE5AKDM4ECYP1A2CYP3A4MAPT | |
| SCHEMBL14474623 | 0.81 | CHRNB2 (0.50) | CHRNB2CHRNA5CHRNA4KDM4ECYP1A2 | |
| SCHEMBL14474593 | 0.80 | CYP11B2 (0.49) | CHRNB2CHRNA5CHRNA4NPC1NPY5R | |
| SCHEMBL16183286 | 0.77 | CHRNB2 (0.47) | CHRNB2CHRNA5CHRNA4NPC1RAB9A | |
| SCHEMBL19204167 | 0.76 | CHRNB2 (0.46) | CHRNB2CHRNA5CHRNA4NPC1RAB9A | |
| SCHEMBL16184295 | 0.76 | CYP1A2 (0.50) | CHRNB2CHRNA5CHRNA4NPC1RAB9A | |
| SCHEMBL14727666 | 0.75 | CHRNB2 (0.46) | CHRNB2CHRNA5CHRNA4NPC1RAB9A | |
| SCHEMBL14731288 | 0.74 | CHRNB2 (0.45) | CHRNB2CHRNA5CHRNA4NPC1RAB9A | |
| SCHEMBL16183594 | 0.72 | CYP1A2 (0.54) | CHRNB2CHRNA5CHRNA4PDE5AKDM4E | |
| SCHEMBL17214444 | 0.71 | CHRNB2 (0.53) | CHRNB2CHRNA5CHRNA4NPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013003586-A1 | QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2013-01-03 | — | — | WO | disclosed |