Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | NCF1 | P14598 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2557489 | 0.78 | NCF1 (0.43) | ALDH1A1HSD17B10NCF1CYP1A2NOS2 | |
| SCHEMBL6852851 | 0.75 | HPGD (0.38) | ALDH1A1HSD17B10LMNAKDM4ENPC1 | |
| SCHEMBL11663983 | 0.74 | CYP1A2 (0.44) | ALDH1A1HSD17B10NCF1CYP1A2NOS2 | |
| SCHEMBL1459296 | 0.74 | NCF1 (0.41) | ALDH1A1HSD17B10NCF1CYP1A2NOS2 | |
| SCHEMBL4064465 | 0.71 | ALDH1A1 (0.50) | ALDH1A1HSD17B10NCF1CYP1A2NOS2 | |
| SCHEMBL3089963 | 0.71 | CYP1A2 (0.48) | ALDH1A1HSD17B10NCF1CYP1A2NOS2 | |
| SCHEMBL20746476 | 0.71 | NCF1 (0.43) | ALDH1A1HSD17B10NCF1CYP1A2NOS2 | |
| SCHEMBL9009627 | 0.69 | NCF1 (0.50) | ALDH1A1HSD17B10NCF1CYP1A2NOS2 | |
| SCHEMBL3057948 | 0.68 | MGAM (0.45) | ALDH1A1HSD17B10CYP1A2MGAMLMNA | |
| SCHEMBL1261380 | 0.67 | CYP1A2 (0.48) | ALDH1A1HSD17B10NCF1CYP1A2NOS2 |
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 3 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 |
| 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 |