Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 1/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KDM5A | P29375 | 1/20 | 0.39 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8744686 | 0.86 | NPY5R (0.47) | ERBB2ADORA1ADORA2AADORA2BKMT2A | |
| SCHEMBL8744773 | 0.84 | KDM4E (0.44) | ADORA1ADORA2AKMT2ACYP2C19KDM5A | |
| SCHEMBL21773988 | 0.83 | ERBB2 (0.46) | ERBB2ADORA1ADORA2AADORA2BKMT2A | |
| SCHEMBL22434857 | 0.75 | KDM4E (0.47) | ERBB2ADORA1KMT2AMEN1TDP1 | |
| SCHEMBL6961083 | 0.72 | MAOA (0.46) | ERBB2ADORA1ADORA2AADORA2BKMT2A | |
| SCHEMBL7142762 | 0.71 | NPY5R (0.64) | KMT2AMEN1TDP1ALDH1A1POLB | |
| SCHEMBL2681245 | 0.71 | ERBB2 (0.61) | ERBB2ADORA1ADORA2AADORA2BKMT2A | |
| SCHEMBL21773983 | 0.68 | SMPD3 (0.42) | ERBB2KMT2ACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8744742 | 0.68 | CYP11B1 (0.43) | ERBB2ADORA1ADORA2AADORA2BKMT2A | |
| SCHEMBL8744781 | 0.68 | — | — |
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 |