Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.54 |
| ▸ | RELA | Q04206 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | HPGDS | O60760 | 14/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6656795 | 0.77 | LDHA (0.44) | SMN1; SMN2HPGDSCYP11B1 | |
| SCHEMBL6850826 | 0.77 | NPC1 (0.50) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL6852078 | 0.77 | NPC1 (0.50) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL13586400 | 0.76 | NPC1 (0.59) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL913164 | 0.75 | NPC1 (0.58) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL6226582 | 0.73 | CLK4 (0.44) | NPC1RAB9A | |
| SCHEMBL6875928 | 0.73 | NPC1 (0.42) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL6851952 | 0.73 | HDAC4 (0.38) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL28522678 | 0.73 | PTGS1 (0.46) | NPC1RAB9ANFKB1NFKB2RELA | |
| SCHEMBL17086136 | 0.73 | PTGS1 (0.46) | NPC1RAB9ANFKB1NFKB2RELA |
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 |