Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 3/20 | 0.44 |
| ▸ | ADAMTS4 | O75173 | 3/20 | 0.44 |
| ▸ | MMP13 | P45452 | 3/20 | 0.44 |
| ▸ | MMP9 | P14780 | 2/20 | 0.44 |
| ▸ | MMP14 | P50281 | 2/20 | 0.44 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.44 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.43 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.43 |
| ▸ | CTRC | Q99895 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7316141 | 0.91 | CA1 (0.44) | CA1CA2CA9CA12CA4 | |
| SCHEMBL7324951 | 0.91 | CTRC (0.43) | CA1CA2CA9CA12CA7 | |
| SCHEMBL7322659 | 0.90 | MMP2 (0.47) | CA1CA2CA9MMP2MMP13 | |
| SCHEMBL7316684 | 0.90 | MMP9 (0.46) | CA1CA2CA9CA12CA4 | |
| SCHEMBL7316889 | 0.86 | MMP1 (0.41) | MMP2MMP13MMP9MMP14MMP1 | |
| SCHEMBL7317445 | 0.83 | MMP13 (0.45) | MMP2ADAMTS4MMP13MMP9MMP14 | |
| SCHEMBL7316126 | 0.82 | TAS2R14 (0.45) | CA1CA2CA9CA7MMP2 | |
| SCHEMBL7322589 | 0.82 | CYP2D6 (0.42) | CA1CA2CA9CA12CA7 | |
| SCHEMBL7310752 | 0.82 | MMP9 (0.47) | CA1CA2CA9CA12CA4 | |
| SCHEMBL7317410 | 0.82 | ALDH1A1 (0.47) | MMP2MMP13MMP9MMP14MMP1 |
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-5929097-A | INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME | AMERICAN CYANAMID COMPANY (US) | 1999-07-27 | — | — | US | disclosed |