Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.40 |
| ▸ | CYSLTR1 | Q9Y271 | 3/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.38 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.38 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9014740 | 0.86 | KDM4E (0.58) | KDM4EALDH1A1SMN1; SMN2PARP1MEN1 | |
| SCHEMBL22773540 | 0.77 | BRD4 (0.51) | KDM4EALDH1A1SMN1; SMN2BRD4CYSLTR2 | |
| SCHEMBL29527187 | 0.77 | BRD4 (0.51) | KDM4EALDH1A1SMN1; SMN2BRD4CYSLTR2 | |
| SCHEMBL22787173 | 0.77 | BRD4 (0.51) | ALDH1A1SMN1; SMN2BRD4PARP1CYSLTR2 | |
| SCHEMBL29526371 | 0.77 | BRD4 (0.51) | ALDH1A1SMN1; SMN2BRD4PARP1CYSLTR2 | |
| SCHEMBL9014694 | 0.74 | LOX (0.35) | CYP1A2 | |
| SCHEMBL9014938 | 0.73 | TNF (0.40) | KDM4EALDH1A1BRD4PARP1CYSLTR2 | |
| SCHEMBL4137212 | 0.72 | KDM4E (0.48) | KDM4EALDH1A1SMN1; SMN2CYP1A2MEN1 | |
| SCHEMBL9014769 | 0.71 | CYP1A2 (0.30) | CYP1A2 | |
| SCHEMBL22773524 | 0.71 | LTB4R (0.37) | SMN1; SMN2PDE3BPDE3AP2RY12 |
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-5578596-A | TREATMENT OF SEROTONERGIC NEURON RELATED DISEASES, MOTION SICKNESS, ANXIXETY, DEPRESSION | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1996-11-26 | — | — | US | disclosed |
| EP-0668276-A1 | 2-ALKOXY-5,6,7,8-TETRAHYDROQUINOXALINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1995-08-23 | — | — | EP | disclosed |