Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.50 |
| ▸ | HPGD | P15428 | 6/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | TOP2A | P11388 | 1/20 | 0.50 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.50 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.41 |
| ▸ | HTR3B | O95264 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.41 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3341252 | 0.84 | KDM4E (0.58) | ALDH1A1KDM4EHPGDHSD17B10LMNA | |
| SCHEMBL9484881 | 0.83 | HTR3E (0.46) | ALDH1A1KDM4EHPGDHTR3EHTR3B | |
| Cyclopropane SCHEMBL3447310 | 0.82 | ALDH1A1 (0.56) | ALDH1A1KDM4EHPGDHSD17B10LMNA | |
| SCHEMBL3401906 | 0.75 | KDM4E (0.52) | ALDH1A1KDM4EHPGDHSD17B10LMNA | |
| SCHEMBL17475410 | 0.74 | KDM4E (0.51) | ALDH1A1KDM4EHPGDHSD17B10LMNA | |
| SCHEMBL10743065 | 0.73 | KDM4E (0.50) | ALDH1A1KDM4EHPGDHSD17B10LMNA | |
| SCHEMBL9008363 | 0.73 | ALDH1A1 (0.53) | ALDH1A1KDM4EHPGDHSD17B10LMNA | |
| SCHEMBL6714523 | 0.73 | HPGD (0.45) | ALDH1A1KDM4EHPGDHSD17B10LMNA | |
| SCHEMBL9379704 | 0.72 | ALDH1A1 (0.58) | ALDH1A1KDM4EHPGDHSD17B10LMNA | |
| SCHEMBL5307312 | 0.72 | KDM4E (0.49) | ALDH1A1KDM4EHPGDHSD17B10LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997020849-A1 | CEPHALOSPORIN FLUOROQUINOLONATE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | LABORATORIOS ARANDA, S.A. DE C.V. (IT) | 1997-06-12 | — | — | WO | claimed |
| US-20020169168-A1 | Pharmaceutical formulations of ciprofloxacin | STREUFF BERND (DE) | 2002-11-14 | — | — | US | disclosed |