Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.49 |
| ▸ | CTSK | P43235 | 1/20 | 0.49 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | METAP2 | P50579 | 1/20 | 0.45 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | KMO | O15229 | 1/20 | 0.39 |
| ▸ | PIN1 | Q13526 | 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 | |
|---|---|---|---|---|
| SCHEMBL7432291 | 0.81 | ADORA2A (0.41) | CTSKLRRK2ADORA2AADORA1RAB9A | |
| SCHEMBL8744690 | 0.81 | KDM4E (0.49) | CTSSCTSKLRRK2ADORA2AADORA1 | |
| SCHEMBL8744764 | 0.81 | CTSS (0.48) | CTSSCTSKADORA2AADORA1IDO1 | |
| SCHEMBL8744714 | 0.80 | CTSS (0.54) | CTSSCTSKLRRK2IDO1 | |
| SCHEMBL8744832 | 0.78 | MCL1 (0.42) | ADORA2AADORA1RAB9AKDM4EMAPT | |
| SCHEMBL10604269 | 0.78 | IDO1 (0.51) | CTSSCTSKIDO1METAP2XDH | |
| SCHEMBL8744699 | 0.77 | CTSS (0.61) | CTSSCTSKIDO1XDHKDM4E | |
| SCHEMBL8744731 | 0.76 | HSP90AB1 (0.45) | KDM4ENPC1MAPT | |
| SCHEMBL25357822 | 0.74 | USP8 (0.38) | LRRK2RAB9AKDM4ENPC1AR | |
| SCHEMBL15029191 | 0.73 | IDO1 (0.47) | ADORA2AADORA1IDO1METAP2XDH |
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 |
|---|---|---|---|---|---|---|---|
| EP-0653421-B1 | Process for preparing 2-cyanoimidazole compounds | ISHIHARA SANGYO KAISHA (JP) | 1997-01-15 | — | — | EP | disclosed |
| US-5552557-A | Process for preparing 2-cyanoimidazole compounds by reaction of an amino ketone compound | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1996-09-03 | — | — | US | disclosed |
| EP-0653421-A1 | Process for preparing 2-cyanoimidazole compounds | ISHIHARA SANGYO KAISHA LTD. (JP) | 1995-05-17 | — | — | EP | disclosed |