Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 5/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.37 |
| ▸ | JAK1 | P23458 | 2/20 | 0.37 |
| ▸ | TYK2 | P29597 | 2/20 | 0.37 |
| ▸ | JAK3 | P52333 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6231516 | 0.93 | KDM4E (0.43) | KDM4ERAD52HTTBACE1JAK2 | |
| SCHEMBL6231518 | 0.85 | KDM4E (0.43) | KDM4ERAD52HTTBACE1JAK2 | |
| SCHEMBL6271695 | 0.83 | KDM4E (0.41) | KDM4ERAD52HTTHDAC1HDAC6 | |
| SCHEMBL6258152 | 0.72 | KDM4E (0.40) | KDM4ERAD52HTTBACE1HDAC6 | |
| SCHEMBL6604741 | 0.72 | KDM4E (0.45) | KDM4ERAD52HTTHDAC6TDP1 | |
| SCHEMBL6234983 | 0.70 | KDM4E (0.45) | KDM4ERAD52HTTTDP1TLR8 | |
| SCHEMBL17487511 | 0.70 | CXCL8 (0.53) | KDM4ERAD52HTTTDP1LMNA | |
| SCHEMBL6233721 | 0.68 | KDM4E (0.44) | KDM4ERAD52HTTBACE1HDAC6 | |
| SCHEMBL18960395 | 0.68 | NTRK1 (0.42) | KDM4ERAD52HTT | |
| SCHEMBL5226357 | 0.67 | HDAC6 (0.48) | KDM4EHTTHDAC1HDAC6TDP1 |
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 |