Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 5/20 | 0.41 |
| ▸ | PPARA | Q07869 | 5/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.41 |
| ▸ | PTGES | O14684 | 4/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.39 |
| ▸ | CETP | P11597 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6930731 | 0.82 | MMP9 (0.56) | MMP9MMP13ADAM17PPARGPPARA | |
| SCHEMBL7691773 | 0.77 | MMP9 (0.49) | MMP9MMP13ADAM17HDAC8HDAC3 | |
| SCHEMBL7616072 | 0.75 | MMP9 (0.51) | MMP9MMP13ADAM17PPARGPPARA | |
| SCHEMBL7393115 | 0.74 | MMP9 (0.51) | MMP9MMP13ADAM17PPARGPPARA | |
| SCHEMBL6932495 | 0.73 | MMP9 (0.55) | MMP9MMP13ADAM17PPARGPPARA | |
| SCHEMBL7511090 | 0.71 | MMP9 (0.48) | MMP9MMP13ADAM17PPARGHDAC8 | |
| SCHEMBL7509127 | 0.71 | MMP9 (0.44) | MMP9MMP13ADAM17PPARGPPARA | |
| SCHEMBL6931609 | 0.69 | MMP9 (0.61) | MMP9MMP13ADAM17PPARGPPARA | |
| SCHEMBL7317662 | 0.69 | MMP9 (0.55) | MMP9MMP13ADAM17PPARGPPARA | |
| SCHEMBL6931550 | 0.68 | MMP9 (0.47) | MMP9MMP13ADAM17PPARGPPARA |
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-6331563-B1 | LOW MOLECULAR WEIGHT, NON-PEPTIDE INHIBITORS OF MATRIX METALLOPROTEINASES AND TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME; TREATING ARTHRITIS, TUMOR METASTASIS, ABNORMAL WOUND HEALING, PERIODONTAL DISEASE, BONE DISEASE, INSULIN RESISTANCE | WYETH HOLDINGS CORPORATION | 2001-12-18 | — | — | US | disclosed |