Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ALOX5AP | P20292 | 4/20 | 0.42 |
| ▸ | FEN1 | P39748 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PTGES2 | Q9H7Z7 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | EIF2AK3 | Q9NZJ5 | 1/20 | 0.37 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28076136 | 0.82 | CCR2 (0.37) | CCR2ALDH1A1PTGES2NPC1HPGD | |
| SCHEMBL28076361 | 0.81 | CCR2 (0.50) | CCR2RAB9AKDM4EALDH1A1PTGES2 | |
| SCHEMBL28076138 | 0.77 | PTGES2 (0.39) | PTGES2NPC1HPGDHTTCA1 | |
| SCHEMBL28076295 | 0.76 | CCR2 (0.48) | CCR2ALOX5APFEN1F10 | |
| SCHEMBL28076150 | 0.71 | PTGS2 (0.57) | CCR2ALDH1A1CA1CA2 | |
| SCHEMBL6820364 | 0.69 | CA2 (0.50) | RAB9AALOX5APFEN1KDM4EALDH1A1 | |
| SCHEMBL610509 | 0.69 | CRHR1 (0.42) | CCR2KDM4EALDH1A1PTGES2HPGD | |
| SCHEMBL5734224 | 0.68 | RAB9A (0.64) | RAB9AKMT2AALOX5APFEN1KDM4E | |
| SCHEMBL12560662 | 0.68 | CCR2 (0.68) | CCR2ALDH1A1 | |
| SCHEMBL2774927 | 0.68 | CCR2 (0.50) | CCR2ALDH1A1PTGES2CA1CA2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103380115-B | Sulfur derivatives as chemokine receptor modulators | 阿勒根公司 | 2016-08-24 | — | — | CN | claimed |
| CN-106220618-B | Sulfur derivatives as chemokine receptor modulators | 阿勒根公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-106220618-A | SULFUR DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS | 阿勒根公司 | 2016-12-14 | — | — | CN | disclosed |
| CN-103380115-B | Sulfur derivatives as chemokine receptor modulators | 阿勒根公司 | 2016-08-24 | — | — | CN | disclosed |