Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | SYK | P43405 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MPI | P34949 | 1/20 | 0.45 |
| ▸ | SNCA | P37840 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL166412 | 0.93 | CCR5 (0.50) | CCR5MAPTALDH1A1ABCB1EGFR | |
| SCHEMBL15204994 | 0.89 | CCR5 (0.47) | CCR5MAPTALDH1A1ABCB1EGFR | |
| SCHEMBL166183 | 0.88 | CCR5 (0.50) | CCR5MAPTALDH1A1ABCB1EGFR | |
| SCHEMBL166797 | 0.84 | CCR5 (0.47) | CCR5MAPTALDH1A1ABCB1EGFR | |
| SCHEMBL15204854 | 0.80 | LRRK2 (0.61) | POLB | |
| SCHEMBL167781 | 0.79 | CCR5 (0.50) | CCR5MAPTALDH1A1KDM4EHTT | |
| SCHEMBL168123 | 0.77 | LRRK2 (0.60) | CCR5MAPTKDM4EHTTSMN1; SMN2 | |
| SCHEMBL168887 | 0.76 | LRRK2 (0.61) | POLB | |
| SCHEMBL165453 | 0.76 | LRRK2 (0.67) | — | |
| SCHEMBL167180 | 0.76 | PTGER1 (0.45) | CCR5MAPTALDH1A1EGFRKDM4E |
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-2012028629-A1 | 2 - (BENZYLOXY) BENZAMIDES AS LRRK2 KINASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2012-03-08 | — | — | WO | disclosed |