Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.47 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.36 |
| ▸ | KIF11 | P52732 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 3/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13741967 | 0.84 | CYP17A1 (0.52) | CYP17A1CYP11B1CYP11B2NOTUMHSD17B1 | |
| SCHEMBL2090822 | 0.79 | DAPK3 (0.44) | HSD17B1HSD17B2 | |
| SCHEMBL2093613 | 0.79 | HSD17B1 (0.44) | CYP17A1CYP11B1CYP11B2NOTUMHSD17B1 | |
| SCHEMBL19665044 | 0.79 | CYP11B1 (0.50) | CYP17A1CYP11B1CYP11B2NOTUMHSD17B1 | |
| SCHEMBL56600 | 0.78 | — | — | |
| SCHEMBL2552043 | 0.77 | CYP11B1 (0.48) | CYP17A1CYP11B1CYP11B2NOTUMHSD17B1 | |
| SCHEMBL7769653 | 0.77 | ALOX5 (0.50) | CYP17A1CYP11B1CYP11B2NOTUMHSD17B1 | |
| SCHEMBL7766400 | 0.77 | CYP11B2 (0.48) | CYP17A1CYP11B1CYP11B2NOTUMHSD17B1 | |
| SCHEMBL28041388 | 0.76 | CES2 (0.39) | NOTUMCES2CES1 | |
| SCHEMBL265481 | 0.75 | NFE2L2 (0.54) | CYP17A1CYP11B1CYP11B2NOTUMPGR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1705670-A | 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds | OTSUKA PHARMA CO LTD (JP) | 2005-12-07 | — | — | CN | disclosed |
| US-6927216-B2 | Cyclic sulfonyl compounds as inhibitors of metalloproteases | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2005-08-09 | — | — | US | disclosed |