Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 11/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.45 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.45 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.45 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL84456 | 0.85 | PARP1 (0.57) | PARP1MAPTPTGS1CXCR1CXCR2 | |
| SCHEMBL30154821 | 0.85 | PARP1 (0.57) | PARP1MAPTPTGS1CXCR1CXCR2 | |
| SCHEMBL597590 | 0.83 | ALDH1A1 (0.46) | MAPTPTGS1CXCR1CXCR2PTGS2 | |
| SCHEMBL211856 | 0.83 | PARP1 (0.55) | PARP1MAPTPTGS1CXCR1CXCR2 | |
| SCHEMBL27626633 | 0.83 | SMN1; SMN2 (0.46) | MAPTPTGS1CXCR1CXCR2PTGS2 | |
| SCHEMBL8255364 | 0.83 | PARP1 (0.55) | PARP1MAPTPTGS1CXCR1CXCR2 | |
| SCHEMBL8249965 | 0.83 | PARP1 (0.55) | PARP1MAPTPTGS1CXCR1CXCR2 | |
| SCHEMBL12052133 | 0.83 | PARP1 (0.55) | PARP1MAPTPTGS1CXCR1CXCR2 | |
| SCHEMBL1179698 | 0.83 | ANPEP (0.54) | MAPTPTGS1CXCR1CXCR2PTGS2 | |
| SCHEMBL215100 | 0.81 | PARP1 (0.53) | PARP1MAPTPTGS1CXCR1CXCR2 |
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-105073742-A | Flap modulators | JANSSEN PHARMACEUTICA NV | 2015-11-18 | — | — | CN | disclosed |