Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GABBR2 | O75899 | 3/20 | 0.34 |
| ▸ | GABBR1 | Q9UBS5 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6186523 | 0.77 | BRD4 (0.45) | BRD4SLC6A4SLC6A3FFAR2 | |
| SCHEMBL6188068 | 0.75 | BRD4 (0.46) | BRD4SLC6A4SLC6A3CES2CES1 | |
| SCHEMBL6192279 | 0.73 | BRD4 (0.45) | BRD4SLC6A4SLC6A3POLBCYP2C9 | |
| SCHEMBL10977277 | 0.73 | SLC6A4 (0.52) | BRD4SLC6A4SLC6A3HDAC4HDAC7 | |
| SCHEMBL6187976 | 0.73 | ADRB2 (0.41) | BRD4SLC6A4SLC6A3FFAR2POLB | |
| SCHEMBL6186361 | 0.71 | PPARG (0.43) | BRD4SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL2788979 | 0.71 | BRD4 (0.59) | BRD4SLC6A4SLC6A3HDAC4HDAC7 | |
| SCHEMBL10882007 | 0.70 | BRD4 (0.63) | BRD4SLC6A4SLC6A3HDAC4HDAC7 | |
| SCHEMBL6185119 | 0.69 | HPGD (0.46) | BRD4CNR2POLBCYP2C19CYP3A4 | |
| SCHEMBL6075209 | 0.69 | SLC6A3 (0.68) | BRD4SLC6A4SLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1539685-A1 | MCP-1 RECEPTOR ANTAGONISTS AND METHOD OF USE THEREOF | Warner-Lambert Company LLC (US) | 2005-06-15 | — | — | EP | disclosed |
| WO-2004014847-A1 | MCP-1 RECEPTOR ANTAGONISTS AND METHOD OF USE THEREOF | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |