Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAM17 | P78536 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | CTSC | P53634 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 2/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.33 |
| ▸ | MMP13 | P45452 | 2/20 | 0.33 |
| ▸ | MASP2 | O00187 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | GCK | P35557 | 1/20 | 0.30 |
| ▸ | MMP2 | P08253 | 2/20 | 0.30 |
| ▸ | MMP3 | P08254 | 1/20 | 0.30 |
| ▸ | BMP1 | P13497 | 1/20 | 0.30 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.30 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7937124 | 0.88 | P2RX3 (0.32) | ALDH1A1GAAOPRK1 | |
| SCHEMBL7937182 | 0.78 | ADAM17 (0.36) | ADAM17ALDH1A1GAAOPRK1CTSC | |
| SCHEMBL6977404 | 0.75 | MASP2 (0.36) | ADAM17ALDH1A1GAAOPRK1CTSC | |
| SCHEMBL6943822 | 0.72 | ADAM17 (0.35) | ADAM17ALDH1A1GAACTSCMMP1 | |
| SCHEMBL6983563 | 0.71 | ALDH1A1 (0.33) | ADAM17ALDH1A1GAACTSCMMP1 | |
| SCHEMBL6939399 | 0.71 | ADAM17 (0.35) | ADAM17CTSCMMP1MMP9MMP13 | |
| SCHEMBL7937125 | 0.70 | ALDH1A1 (0.31) | ALDH1A1GAACTSC | |
| SCHEMBL6986114 | 0.69 | ALDH1A1 (0.31) | ADAM17ALDH1A1GAAMMP1MMP9 | |
| SCHEMBL6942160 | 0.67 | ADAM17 (0.37) | ADAM17CTSCMMP1MMP9MMP13 | |
| SCHEMBL6982221 | 0.67 | REN (0.34) | ALDH1A1GAACTSCMASP2 |
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-6235787-B1 | ANTIINFLAMMATORY AGENTS; RHEUMATIC DISEASES; BONE DISORDERS; SKIN DISORDERS; MULTIPLE SCLEROSIS | HOFFMANN-LA ROCHE INC. | 2001-05-22 | — | — | US | disclosed |