Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4597509 | 0.87 | LMNA (0.40) | KDM4EMAPTAKT1HPGDRORC | |
| SCHEMBL3710918 | 0.85 | CTSS (0.41) | AKT1NPC1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL29949477 | 0.84 | CTSL (0.42) | CTSLCYP2B6SCN5ASCN9AKDM4E | |
| SCHEMBL26257358 | 0.84 | CTSL (0.42) | CTSLCYP2B6SCN5ASCN9AKDM4E | |
| SCHEMBL25399092 | 0.84 | CTSL (0.42) | CTSLCYP2B6SCN5ASCN9AKDM4E | |
| SCHEMBL19731493 | 0.83 | CTSL (0.42) | CTSLCYP2B6SCN5ASCN9AKDM4E | |
| SCHEMBL24944766 | 0.83 | CTSL (0.42) | CTSLCYP2B6SCN5ASCN9AKDM4E | |
| SCHEMBL19879722 | 0.83 | CTSL (0.39) | CTSLSCN5ASCN9AKDM4EMAPT | |
| SCHEMBL24944947 | 0.81 | EPAS1 (0.39) | IDO1GAA | |
| SCHEMBL4596148 | 0.80 | EPHX2 (0.41) | CTSLMAPTNPC1HPGDRAB9A |
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-1924265-A2 | CHEMOKINE RECEPTOR BINDING COMPOUNDS | Genzyme Corporation (US) | 2008-05-28 | — | — | EP | disclosed |
| WO-2007022371-A2 | CHEMOKINE RECEPTOR BINDING COMPOUNDS | GENZYME CORPORATION (US) | 2007-02-22 | — | — | WO | disclosed |