Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAM17 | P78536 | 5/20 | 0.37 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 5/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 7/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | ATM | Q13315 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 6/20 | 0.32 |
| ▸ | RECQL | P46063 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | REN | P00797 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NPR3 | P17342 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | LARS1 | Q9P2J5 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4481740 | 0.88 | ADAM17 (0.46) | ADAM17CYP2C19LARS1 | |
| SCHEMBL6942610 | 0.88 | ADAM17 (0.46) | ADAM17CYP2C19LARS1 | |
| SCHEMBL6944661 | 0.83 | ADAM17 (0.34) | ADAM17PSMB5CYP2C19POLBMAPT | |
| SCHEMBL6939550 | 0.81 | MMP1 (0.38) | ADAM17PSMB5POLBGAAMAPT | |
| SCHEMBL6986272 | 0.81 | MAPT (0.34) | ADAM17PSMB5CYP2C19POLBGAA | |
| SCHEMBL6945999 | 0.81 | ADAM17 (0.43) | ADAM17CYP2C19 | |
| SCHEMBL6945409 | 0.81 | ADAM17 (0.43) | ADAM17CYP2C19 | |
| SCHEMBL6940038 | 0.81 | — | — | |
| SCHEMBL6941767 | 0.80 | ADAM17 (0.46) | ADAM17CYP2C19LARS1 | |
| SCHEMBL6946650 | 0.80 | ADAM17 (0.36) | ADAM17PSMB5POLBGAAMAPT |
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 |