Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PRNP | P04156 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19782862 | 1.00 | CCR1 (0.34) | CCR1CCR5CCR8ALDH1A1PRNP | |
| SCHEMBL30189933 | 0.83 | S1PR4 (0.33) | ALDH1A1MAPTCA2CYP11B1CYP11B2 | |
| SCHEMBL19783603 | 0.83 | S1PR4 (0.33) | ALDH1A1MAPTCA2CYP11B1CYP11B2 | |
| SCHEMBL19783610 | 0.81 | TLR7 (0.32) | CCR1CCR5CCR8 | |
| SCHEMBL19783279 | 0.81 | CCR1 (0.36) | CCR1CCR5CCR8PRNPNPSR1 | |
| SCHEMBL30189704 | 0.79 | CCR1 (0.33) | CCR1CCR5CCR8GRM5CYP11B1 | |
| SCHEMBL19783287 | 0.79 | CCR1 (0.33) | CCR1CCR5CCR8GRM5CYP11B1 | |
| SCHEMBL19782773 | 0.76 | NOS1 (0.38) | CCR1CCR5CCR8ALDH1A1MAPT | |
| SCHEMBL19783554 | 0.76 | LMNA (0.34) | ALDH1A1GRM5CA2CYP11B1CYP11B2 | |
| SCHEMBL19776334 | 0.76 | MAPT (0.39) | CCR1CCR5CCR8ALDH1A1PRNP |
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 |
|---|---|---|---|---|---|---|---|
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |