Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP3 | P08254 | 4/20 | 0.74 |
| ▸ | MMP7 | P09237 | 3/20 | 0.74 |
| ▸ | MMP13 | P45452 | 3/20 | 0.74 |
| ▸ | MMP12 | P39900 | 2/20 | 0.74 |
| ▸ | MMP2 | P08253 | 1/20 | 0.74 |
| ▸ | ADAM17 | P78536 | 16/20 | 0.65 |
| ▸ | ADAMTS4 | O75173 | 3/20 | 0.65 |
| ▸ | ADAMTS1 | Q9UHI8 | 3/20 | 0.65 |
| ▸ | ADAMTS5 | Q9UNA0 | 3/20 | 0.65 |
| ▸ | MMP8 | P22894 | 2/20 | 0.55 |
| ▸ | MMP10 | P09238 | 1/20 | 0.54 |
| ▸ | MMP14 | P50281 | 1/20 | 0.54 |
| ▸ | MMP15 | P51511 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL5255328 | 0.96 | MMP3 (0.81) | MMP3MMP7MMP13MMP12MMP2 | |
| Trifluoroacetic Acid SCHEMBL5255529 | 0.87 | ADAM17 (0.69) | MMP3MMP7MMP13MMP12MMP2 | |
| Trifluoroacetic Acid SCHEMBL6598115 | 0.84 | ADAM17 (0.91) | MMP3MMP7MMP13ADAM17ADAMTS4 | |
| SCHEMBL5253094 | 0.83 | ADAM17 (0.73) | MMP3MMP7MMP13MMP12MMP2 | |
| SCHEMBL5866693 | 0.82 | MMP3 (0.53) | MMP3MMP7MMP13MMP12MMP2 | |
| Trifluoroacetic Acid SCHEMBL6600904 | 0.82 | ADAM17 (0.84) | MMP3MMP7MMP13ADAM17ADAMTS4 | |
| Trifluoroacetic Acid SCHEMBL6594200 | 0.82 | ADAM17 (0.84) | MMP3MMP7MMP13ADAM17ADAMTS4 | |
| Trifluoroacetic Acid SCHEMBL6594386 | 0.82 | ADAM17 (0.84) | MMP3MMP7MMP13ADAM17ADAMTS4 | |
| Trifluoroacetic Acid SCHEMBL5866653 | 0.80 | MMP2 (0.56) | MMP3MMP13MMP12MMP2ADAM17 | |
| SCHEMBL5219500 | 0.80 | ADAM17 (0.83) | MMP3MMP7MMP13MMP12MMP2 |
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-7074810-B2 | Triazolone and triazolethione derivatives as inhibitors of matrix metalloproteinases and/or TNF-α converting enzyme | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-07-11 | — | — | US | disclosed |
| US-20040116491-A1 | Triazolone and triazolethione derivatives as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme | BRISTOL-MYERS SQUIBB COMPANY | 2004-06-17 | — | — | US | disclosed |