Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR2 | P25025 | 14/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | MTOR | P42345 | 2/20 | 0.37 |
| ▸ | TSPO | P30536 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | NT5E | P21589 | 1/20 | 0.30 |
| ▸ | RAB7A | P51149 | 1/20 | 0.30 |
| ▸ | CXCR4 | P61073 | 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 | |
|---|---|---|---|---|
| SCHEMBL6314287 | 0.88 | CXCR2 (0.41) | CXCR2TSPOALDH1A1LMNAMAPT | |
| SCHEMBL5837750 | 0.87 | GABRA1 (0.35) | CXCR2PIK3CAMTORTSPOALDH1A1 | |
| SCHEMBL5838257 | 0.87 | CXCR2 (0.39) | CXCR2PIK3CAMTORTSPOALDH1A1 | |
| SCHEMBL6316317 | 0.87 | CXCR2 (0.35) | CXCR2TSPOALDH1A1LMNAMAPT | |
| SCHEMBL5837587 | 0.86 | CXCR2 (0.34) | CXCR2PIK3CAMTORALDH1A1LMNA | |
| SCHEMBL5836667 | 0.86 | CXCR2 (0.36) | CXCR2TSPOALDH1A1LMNAMAPT | |
| SCHEMBL5837570 | 0.85 | ALDH1A1 (0.35) | CXCR2ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL6322122 | 0.82 | RAB7A (0.42) | CXCR2TSPOALDH1A1LMNAMAPT | |
| SCHEMBL5838623 | 0.81 | CXCR2 (0.38) | CXCR2TSPOALDH1A1LMNAMAPT | |
| SCHEMBL5838560 | 0.81 | CXCR2 (0.37) | CXCR2TSPOALDH1A1LMNAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7115624-B1 | Method of inhibiting protein tyrosine phosphatase 1B and/or T-cell protein tyrosine phosphatase 4 and/or other PTPases with an Asp residue at position 48 | NOVO NORDISK A/S (DK) | 2006-10-03 | — | — | US | disclosed |
| US-7019026-B1 | Modulators of Protein Tyrosine Phosphatases (PTPases) | NOVO NORDISK A/S (DK) | 2006-03-28 | — | — | US | disclosed |
| EP-1214325-B1 | MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) | NOVO NORDISK AS (DK) | 2005-11-09 | — | — | EP | disclosed |