Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NEK2 | P51955 | 2/20 | 0.44 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
| ▸ | QDPR | P09417 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.41 |
| ▸ | CYP21A2 | P08686 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 2/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL6851701 | 1.00 | NEK2 (0.44) | NEK2PLK1QDPRCYP17A1CYP11B1 | |
| SCHEMBL6851702 | 1.00 | NEK2 (0.44) | NEK2PLK1QDPRCYP17A1CYP11B1 | |
| SCHEMBL6879593 | 0.82 | ATM (0.39) | ERN1HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL6879589 | 0.82 | ATM (0.39) | ERN1HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL6879587 | 0.82 | ATM (0.39) | ERN1HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL6851674 | 0.82 | MKNK1 (0.54) | CYP11B1KIF11CYP19A1CYP11B2CYP3A4 | |
| SCHEMBL6851676 | 0.82 | MKNK1 (0.54) | CYP11B1KIF11CYP19A1CYP11B2CYP3A4 | |
| SCHEMBL6851680 | 0.82 | MKNK1 (0.54) | CYP11B1KIF11CYP19A1CYP11B2CYP3A4 | |
| SCHEMBL6876193 | 0.80 | CYP2D6 (0.43) | NEK2PLK1MAPTCYP3A4CYP2D6 | |
| SCHEMBL6876200 | 0.80 | CYP2D6 (0.43) | NEK2PLK1MAPTCYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |