Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN2 | P17655 | 4/20 | 0.49 |
| ▸ | MMP2 | P08253 | 15/20 | 0.45 |
| ▸ | MMP7 | P09237 | 15/20 | 0.45 |
| ▸ | MMP3 | P08254 | 14/20 | 0.45 |
| ▸ | MMP1 | P03956 | 13/20 | 0.45 |
| ▸ | MMP9 | P14780 | 2/20 | 0.43 |
| ▸ | MMP12 | P39900 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8202847 | 0.97 | CAPN2 (0.46) | CAPN2MMP2MMP7MMP3MMP1 | |
| Hydrochloric Acid SCHEMBL931143 | 0.96 | CAPN2 (0.45) | CAPN2MMP2MMP7MMP3MMP1 | |
| Hydrochloric Acid SCHEMBL931142 | 0.95 | CAPN2 (0.45) | CAPN2MMP2MMP7MMP3MMP1 | |
| SCHEMBL8203297 | 0.88 | CAPN2 (0.52) | CAPN2MMP2MMP7MMP3MMP1 | |
| Hydrochloric Acid SCHEMBL929978 | 0.88 | CAPN2 (0.51) | CAPN2MMP2MMP7MMP3MMP1 | |
| SCHEMBL12943095 | 0.87 | CAPN2 (0.53) | CAPN2MMP2MMP7MMP3MMP1 | |
| SCHEMBL931566 | 0.85 | MMP2 (0.53) | CAPN2MMP2MMP7MMP3MMP1 | |
| Hydrochloric Acid SCHEMBL931565 | 0.85 | MMP2 (0.52) | CAPN2MMP2MMP7MMP3MMP1 | |
| SCHEMBL931561 | 0.85 | CAPN2 (0.56) | CAPN2MMP2MMP7MMP3MMP1 | |
| SCHEMBL8213651 | 0.84 | CAPN2 (0.46) | CAPN2MMP2MMP7MMP3MMP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008048121-A2 | MACROCYCLIC CYSTEINE PROTEASE INHIBITORS AND COMPOSITIONS THEREOF | LINCOLN UNIVERSITY (NZ) | 2008-04-24 | — | — | WO | disclosed |