Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 5/20 | 0.77 |
| ▸ | USP2 | O75604 | 1/20 | 0.77 |
| ▸ | POLB | P06746 | 1/20 | 0.77 |
| ▸ | HPGD | P15428 | 1/20 | 0.77 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.77 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.77 |
| ▸ | CASP1 | P29466 | 1/20 | 0.77 |
| ▸ | CASP7 | P55210 | 1/20 | 0.77 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | F12 | P00748 | 6/20 | 0.60 |
| ▸ | MAOB | P27338 | 3/20 | 0.58 |
| ▸ | MAOA | P21397 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL1367802 | 0.88 | GPR35 (0.79) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL9068668 | 0.87 | GPR35 (1.00) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL30110275 | 0.85 | GPR35 (0.74) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL17037290 | 0.85 | GPR35 (0.74) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL52311 | 0.79 | HPGD (0.69) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL11494991 | 0.78 | MAOB (0.77) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL11746375 | 0.77 | GPR35 (0.54) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL8171798 | 0.74 | GPR35 (0.58) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL1365882 | 0.72 | MAOB (0.78) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL30110368 | 0.72 | GPR35 (0.74) | GPR35HPGDALDH1A1MAPTMAOB |
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 |
|---|---|---|---|---|---|---|---|
| CN-115368333-B | Ibuprofen-coumarin skeleton-containing compound and application thereof | 湖北医药学院 | 2024-11-19 | — | — | CN | disclosed |
| CN-115368333-A | Compound containing ibuprofen-coumarin skeleton and application thereof | 湖北医药学院 | 2022-11-22 | — | — | CN | disclosed |