Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 3/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7584565 | 0.76 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL7519554 | 0.76 | DRD2 (0.34) | ALDH1A1SMN1; SMN2DRD2DRD4DRD3 | |
| SCHEMBL25756589 | 0.67 | CYP1B1 (0.46) | ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL7574776 | 0.66 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2MEN1KMT2AKCNH2 | |
| SCHEMBL7576603 | 0.65 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL4864333 | 0.60 | TNF (0.36) | ALDH1A1MEN1KMT2AKDM4EHPGD | |
| SCHEMBL28021384 | 0.57 | RAB9A (0.53) | ALDH1A1SMN1; SMN2MEN1CYP2D6CYP2C19 | |
| SCHEMBL20478946 | 0.56 | KMT2A (0.47) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL25031058 | 0.55 | LGMN (0.61) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL4306584 | 0.54 | MAPT (0.37) | ALDH1A1SMN1; SMN2MEN1KMT2ACA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1226146-A2 | QUINOLINE AND NAPHTHYRIDINE CARBOXYLIC ACID ANTIBACTERIALS | ABBOTT LABORATORIES (US) | 2002-07-31 | — | — | EP | disclosed |
| WO-2001032655-A2 | QUINOLINE AND NAPHTHYRIDINE CARBOXYLIC ACID ANTIBACTERIALS | ABBOTT LABORATORIES (US) | 2001-05-10 | — | — | WO | disclosed |