Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | RAD52 | P43351 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9775863 | 0.90 | ALDH1A1 (0.52) | ALDH1A1DRD3KDM4EHPGDMEN1 | |
| SCHEMBL7240040 | 0.89 | LMNA (0.51) | ALDH1A1DRD3KDM4EHPGDMEN1 | |
| SCHEMBL9094359 | 0.88 | ALDH1A1 (0.55) | ALDH1A1DRD3KDM4EHPGDMEN1 | |
| Hydrochloric Acid SCHEMBL9097124 | 0.87 | ALDH1A1 (0.54) | ALDH1A1DRD3KDM4EHPGDMEN1 | |
| SCHEMBL8942031 | 0.86 | KMT2A (0.46) | ALDH1A1DRD3KDM4EHPGDKMT2A | |
| SCHEMBL8942041 | 0.86 | TOP1 (0.42) | ALDH1A1DRD3KDM4EHPGDMEN1 | |
| SCHEMBL8941986 | 0.85 | ALDH1A1 (0.38) | ALDH1A1DRD3KDM4EHPGDMEN1 | |
| SCHEMBL9775969 | 0.85 | ALDH1A1 (0.67) | ALDH1A1DRD3KDM4EHPGDMEN1 | |
| SCHEMBL9775890 | 0.85 | DRD3 (0.67) | ALDH1A1DRD3KDM4EHPGDMEN1 | |
| SCHEMBL9775920 | 0.85 | ALDH1A1 (0.52) | ALDH1A1DRD3KDM4EHPGDMEN1 |
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-5004745-A | Benzo[1,8]naphthyridine derivatives, their preparation and the compositions which contain them | LABORATOIRE ROGER BELLON (FR) | 1991-04-02 | — | — | US | disclosed |
| US-4990515-A | Chemical intermediates | RHONE-POULENC SANTE (FR) | 1991-02-05 | — | — | US | disclosed |
| US-4970213-A | Benzo(1,8)naphthyridine derivatives as intermediates | RHONE-POULENC SANTE (FR) | 1990-11-13 | — | — | US | disclosed |