Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | APAF1 | O14727 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6231518 | 0.76 | KDM4E (0.43) | KDM4ERAD52HTTBRD4ALDH1A1 | |
| SCHEMBL6271695 | 0.74 | KDM4E (0.41) | KDM4ERAD52HTTBRD4ALDH1A1 | |
| SCHEMBL6231516 | 0.74 | KDM4E (0.43) | KDM4ERAD52HTTALDH1A1BACE1 | |
| SCHEMBL6232949 | 0.72 | KDM4E (0.41) | KDM4ERAD52HTTALDH1A1NQO2 | |
| SCHEMBL6234983 | 0.71 | KDM4E (0.45) | KDM4ERAD52HTTBRD4ALDH1A1 | |
| SCHEMBL6604741 | 0.65 | KDM4E (0.45) | KDM4ERAD52HTTALDH1A1TDP1 | |
| SCHEMBL3758450 | 0.62 | ESRRG (0.51) | KDM4EALDH1A1HDAC6HPGDKMT2A | |
| SCHEMBL617943 | 0.62 | KDM4E (0.68) | KDM4ERAD52HTTALDH1A1TDP1 | |
| SCHEMBL18960395 | 0.62 | NTRK1 (0.42) | KDM4ERAD52HTTBRD4KMT2A | |
| SCHEMBL17487511 | 0.62 | CXCL8 (0.53) | KDM4ERAD52HTTALDH1A1TDP1 |
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-2004092181-A9 | HETEROCYCLIC MCHR1 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-01-27 | — | — | WO | disclosed |