Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 13/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | WNT3A | P56704 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | STS | P08842 | 1/20 | 0.39 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 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 | |
|---|---|---|---|---|
| SCHEMBL18280925 | 1.00 | GRIN2B (0.69) | GRIN2BKCNH2CYP2D6WNT3AMEN1 | |
| SCHEMBL18280927 | 1.00 | GRIN2B (0.69) | GRIN2BKCNH2CYP2D6WNT3AMEN1 | |
| SCHEMBL20203122 | 0.88 | GRIN2B (0.61) | GRIN2BKCNH2CYP2D6WNT3AKMT2A | |
| SCHEMBL20189375 | 0.88 | GRIN2B (0.69) | GRIN2BKCNH2CYP2D6GPR119 | |
| SCHEMBL18280970 | 0.88 | GRIN2B (0.69) | GRIN2BKCNH2CYP2D6GPR119 | |
| SCHEMBL20203123 | 0.88 | GRIN2B (0.61) | GRIN2BKCNH2CYP2D6WNT3AKMT2A | |
| SCHEMBL18280967 | 0.88 | GRIN2B (0.69) | GRIN2BKCNH2CYP2D6GPR119 | |
| SCHEMBL20190282 | 0.88 | GRIN2B (0.61) | GRIN2BKCNH2CYP2D6WNT3AKMT2A | |
| SCHEMBL20202904 | 0.88 | GRIN2B (0.54) | GRIN2BKCNH2CYP2D6GPR119 | |
| SCHEMBL20190181 | 0.88 | GRIN2B (0.54) | GRIN2BKCNH2CYP2D6GPR119 |
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-3544610-A1 | TREATMENT OF AUTISM SPECTRUM DISORDERS, OBSESSIVE-COMPULSIVE DISORDER AND ANXIETY DISORDERS | Rugen Holdings (Cayman) Limited (KY) | 2019-10-02 | — | — | EP | disclosed |
| WO-2018098128-A1 | TREATMENT OF AUTISM SPECTRUM DISORDERS, OBSESSIVE-COMPULSIVE DISORDER AND ANXIETY DISORDERS | RUGEN HOLDINGS (CAYMAN) LIMITED (KY) | 2018-05-31 | — | — | WO | disclosed |