Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CXCL12 | P48061 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL423183 | 0.83 | PDE2A (0.61) | PDE2AALDH1A1KDM4ECYP1A2POLB | |
| SCHEMBL10645292 | 0.80 | NPC1 (0.50) | PDE2AALDH1A1KDM4ECYP1A2POLB | |
| SCHEMBL3109540 | 0.79 | ALDH1A1 (0.42) | PDE2AALDH1A1KDM4ECYP1A2POLB | |
| SCHEMBL3175016 | 0.77 | LMNA (0.55) | ALDH1A1KDM4ECYP1A2LMNASMN1; SMN2 | |
| SCHEMBL12432408 | 0.77 | ALDH1A1 (0.41) | PDE2AALDH1A1KDM4ECYP1A2POLB | |
| SCHEMBL125608 | 0.77 | — | — | |
| Chloromethane SCHEMBL10817771 | 0.77 | NPC1 (0.47) | PDE2AALDH1A1KDM4ECYP1A2POLB | |
| SCHEMBL23949977 | 0.77 | NUDT1 (0.51) | PDE2AALDH1A1KDM4ECYP1A2LMNA | |
| SCHEMBL7052100 | 0.76 | PDE2A (0.55) | PDE2AALDH1A1KDM4ECYP1A2LMNA | |
| SCHEMBL29450819 | 0.76 | PDE2A (0.55) | PDE2AALDH1A1KDM4ECYP1A2LMNA |
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-2174934-B1 | OXOPYRAZINE DERIVATIVE AND HERBICIDE | KUMIAI CHEMICAL INDUSTRY CO (JP) | 2012-06-06 | — | — | EP | disclosed |
| EP-2407451-A1 | N,N-substituted 3-aminopyrrolidine compounds useful as monoamines reuptake inhibitors | Otsuka Pharmaceutical Co., Ltd. (JP) | 2012-01-18 | — | — | EP | disclosed |