Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 6/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.41 |
| ▸ | HPGD | P15428 | 6/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | TOP2A | P11388 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TOP1 | P11387 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | EPHA2 | P29317 | 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 | |
|---|---|---|---|---|
| SCHEMBL9047814 | 0.89 | ALDH1A1 (0.35) | ALDH1A1KDM4EDRD3LMNAHSD17B10 | |
| SCHEMBL8095031 | 0.86 | DRD3 (0.59) | ALDH1A1KDM4EDRD3LMNAHSD17B10 | |
| SCHEMBL8097813 | 0.85 | KDM4E (0.59) | ALDH1A1KDM4ELMNAHSD17B10HPGD | |
| SCHEMBL8092840 | 0.82 | HSD17B10 (0.41) | ALDH1A1KDM4EDRD3LMNAHSD17B10 | |
| SCHEMBL9045127 | 0.79 | TOP1 (0.61) | ALDH1A1KDM4EDRD3LMNAHSD17B10 | |
| SCHEMBL9685536 | 0.79 | ALDH1A1 (0.53) | ALDH1A1KDM4EDRD3LMNAHSD17B10 | |
| SCHEMBL9686810 | 0.78 | ALDH1A1 (0.50) | ALDH1A1KDM4EDRD3LMNAHSD17B10 | |
| SCHEMBL8138695 | 0.78 | ALDH1A1 (0.42) | ALDH1A1KDM4EDRD3LMNAHSD17B10 | |
| SCHEMBL9147313 | 0.78 | ALDH1A1 (0.45) | ALDH1A1KDM4EDRD3LMNAHSD17B10 | |
| SCHEMBL9145291 | 0.78 | ALDH1A1 (0.45) | ALDH1A1KDM4EDRD3LMNAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-6018054-A | INTERMEDIATE COMPOUNDS FOR PREPARING NOVEL QUINOLONE AND NAPHTHYRIDONE DERIVATIVES WHICH ARE SUBSTITUTED IN THE 7-POSITION BY A PARTIALLY HYDROGENATED ISOINDOLINYL RING, USE AS ANTIBACTERIAL AGENTS AND AS FEED ADDITIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-01-25 | — | — | US | disclosed |
| US-5556979-A | ANIMAL FEEDS | BAYER AKTIENGESELLSCHAFT (DE) | 1996-09-17 | — | — | US | disclosed |