Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAM17 | P78536 | 3/20 | 0.57 |
| ▸ | GRIK1 | P39086 | 3/20 | 0.37 |
| ▸ | GRIK2 | Q13002 | 3/20 | 0.37 |
| ▸ | HTR2A | P28223 | 3/20 | 0.34 |
| ▸ | CTSC | P53634 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 5/20 | 0.33 |
| ▸ | MMP3 | P08254 | 4/20 | 0.33 |
| ▸ | MMP7 | P09237 | 3/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | ANPEP | P15144 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 4/20 | 0.33 |
| ▸ | MMP8 | P22894 | 3/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.33 |
| ▸ | MMP13 | P45452 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | MMP12 | P39900 | 1/20 | 0.33 |
| ▸ | MMP14 | P50281 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6943851 | 0.93 | ADAM17 (0.67) | ADAM17MMP2MMP3MMP7MMP1 | |
| SCHEMBL6986274 | 0.89 | ADAM17 (0.52) | ADAM17GRIK1GRIK2 | |
| SCHEMBL6945913 | 0.87 | ADAM17 (0.63) | ADAM17GRIK1GRIK2HTR2ACTSC | |
| SCHEMBL6939982 | 0.86 | ADAM17 (0.59) | ADAM17GRIK1GRIK2HTR2ACTSC | |
| SCHEMBL7930987 | 0.82 | ADAM17 (0.55) | ADAM17GRIK1GRIK2HTR2ACTSC | |
| SCHEMBL8097968 | 0.81 | ADAM17 (0.73) | ADAM17MMP2MMP3MMP7LTA4H | |
| SCHEMBL6942575 | 0.81 | ADAM17 (0.73) | ADAM17MMP2MMP3MMP7LTA4H | |
| SCHEMBL6942562 | 0.81 | ADAM17 (0.73) | ADAM17MMP2MMP3MMP7LTA4H | |
| SCHEMBL6942567 | 0.81 | ADAM17 (0.73) | ADAM17MMP2MMP3MMP7LTA4H | |
| SCHEMBL6984060 | 0.81 | ADAM17 (0.47) | ADAM17CTSCMMP2LTA4HANPEP |
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 |
|---|---|---|---|---|---|---|---|
| US-6265446-B1 | ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASES | HOFFMANN-LA ROCHE INC.. | 2001-07-24 | — | — | US | disclosed |
| US-6239151-B1 | TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES, OSTEOARTHRITIS, RESPIRATORY DISEASES, TUMORS, CACHEXIA, CARDIOVASCULAR DISEASES, FEVER, HAEMORRHAGE AND SEPSIS, HYDRAZINE DERIVATIVES, | HOFFMANN-LA ROCHE INC. | 2001-05-29 | — | — | US | disclosed |