Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 11/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | BRS3 | P32247 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29378377 | 0.90 | NOTUM (0.55) | NOTUMCYP19A1BRS3KEAP1CA2 | |
| SCHEMBL4970815 | 0.83 | NOTUM (0.51) | NOTUMCYP19A1BRS3KEAP1 | |
| SCHEMBL533418 | 0.82 | NOTUM (0.58) | NOTUMCYP19A1BRS3KEAP1 | |
| SCHEMBL4966052 | 0.82 | NOTUM (0.50) | NOTUMCYP19A1BRS3KEAP1 | |
| SCHEMBL14567879 | 0.82 | CYP19A1 (0.63) | NOTUMCYP19A1BRS3CA2TBXAS1 | |
| SCHEMBL13527241 | 0.81 | CYP19A1 (0.61) | NOTUMCYP19A1BRS3CA2TBXAS1 | |
| SCHEMBL6850531 | 0.79 | NOTUM (0.55) | NOTUMCYP19A1BRS3KEAP1 | |
| SCHEMBL12844428 | 0.79 | CYP19A1 (0.59) | NOTUMCYP19A1BRS3KEAP1 | |
| SCHEMBL16093330 | 0.79 | NOTUM (0.55) | NOTUMCYP19A1BRS3KEAP1 | |
| SCHEMBL21156935 | 0.78 | NOTUM (0.54) | NOTUMCYP19A1BRS3KEAP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1585775-A | 6-O-acyl ketolide derivatives of erythromycine useful as antibacterials | ORTHO MCNEIL PHARM INC (US) | 2005-02-23 | — | — | CN | disclosed |
| US-6825170-B2 | ERYTHROMYCIN TYPE MACROLIDE WITH A FUSED OXAZOLONE RING | ORTHO-MCNEIL PHARMACEUTICAL, INC. | 2004-11-30 | — | — | US | disclosed |
| EP-1453847-A1 | 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS | Ortho-Mcneil Pharmaceutical, Inc. (US) | 2004-09-08 | — | — | EP | disclosed |
| WO-2003050132-A1 | 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2003-06-19 | — | — | WO | disclosed |