Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GPR119 | Q8TDV5 | 11/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9021016 | 0.96 | CCR5 (0.46) | CCR5ALDH1A1MAPTLMNAGPR119 | |
| SCHEMBL9020726 | 0.93 | CCR5 (0.43) | CCR5ALDH1A1MAPTLMNAKDM4E | |
| SCHEMBL9020408 | 0.89 | CCR5 (0.44) | CCR5ALDH1A1MAPTLMNAKDM4E | |
| SCHEMBL9399646 | 0.88 | CCR5 (0.45) | CCR5ALDH1A1MAPTKDM4EHPGD | |
| SCHEMBL9399096 | 0.86 | ALDH1A1 (0.43) | CCR5ALDH1A1MAPTLMNAGPR119 | |
| SCHEMBL9020556 | 0.83 | CCR5 (0.43) | CCR5ALDH1A1MAPTLMNAGPR119 | |
| SCHEMBL9020521 | 0.81 | ALDH1A1 (0.41) | CCR5ALDH1A1MAPTHPGD | |
| SCHEMBL9399794 | 0.80 | CCR5 (0.48) | CCR5ALDH1A1MAPTLMNAGPR119 | |
| SCHEMBL9020497 | 0.80 | RAB9A (0.40) | CCR5ALDH1A1MAPTHPGD | |
| SCHEMBL9020352 | 0.80 | CCR5 (0.42) | CCR5ALDH1A1MAPTLMNAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5374720-A | A thienamycins bactericides has nontoxic, side effect reduction against the kidney and central nervous system | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1994-12-20 | — | — | US | disclosed |