Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 7/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | UTS2R | Q9UKP6 | 3/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6409219 | 0.99 | CCR5 (0.43) | CCR5CTSBCTSSCTSKUTS2R | |
| Hydrochloric Acid SCHEMBL6415642 | 0.92 | CCR5 (0.46) | CCR5CTSBCTSSCTSKUTS2R | |
| SCHEMBL6409295 | 0.90 | CCR5 (0.44) | CCR5CTSBCTSSCTSKUTS2R | |
| SCHEMBL6409300 | 0.90 | CCR5 (0.44) | CCR5CTSBCTSSCTSKUTS2R | |
| Hydrochloric Acid SCHEMBL6410911 | 0.90 | UTS2R (0.46) | CCR5CTSBCTSSCTSKUTS2R | |
| Hydrochloric Acid SCHEMBL6415352 | 0.90 | CCR5 (0.43) | CCR5CTSBCTSSCTSKUTS2R | |
| Hydrochloric Acid SCHEMBL6417392 | 0.90 | CCR5 (0.44) | CCR5CTSBCTSSCTSKMEN1 | |
| Hydrochloric Acid SCHEMBL6415357 | 0.90 | CCR5 (0.43) | CCR5CTSBCTSSCTSKUTS2R | |
| Hydrochloric Acid SCHEMBL6432231 | 0.90 | CCR5 (0.44) | CCR5CTSBCTSSCTSKMEN1 | |
| SCHEMBL6409059 | 0.89 | CCR5 (0.47) | CCR5SIGMAR1ALDH1A1LMNA |
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-1776362-A1 | SPIRO COMPOUNDS AND METHODS FOR THE MODULATION OF CHEMOKINE RECEPTOR ACTIVITY | Virochem Pharma Inc. (CA) | 2007-04-25 | — | — | EP | disclosed |
| WO-2005007656-A1 | SPIRO COMPOUNDS AND METHODS FOR THE MODULATION OF CHEMOKINE RECEPTOR ACTIVITY | VIROCHEM PHARMA INC. (CA) | 2005-01-27 | — | — | WO | disclosed |