Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4793090 | 0.85 | SMN1; SMN2 (0.53) | SMN1; SMN2KDM4EALDH1A1TSHRPOLB | |
| SCHEMBL4072195 | 0.84 | SMN1; SMN2 (0.46) | SMN1; SMN2KDM4EALDH1A1TSHRPOLB | |
| SCHEMBL1267622 | 0.79 | SMN1; SMN2 (0.53) | SMN1; SMN2KDM4EALDH1A1TSHRPOLB | |
| SCHEMBL4069218 | 0.77 | SMN1; SMN2 (0.44) | SMN1; SMN2KDM4EALDH1A1TSHRPOLB | |
| SCHEMBL5739853 | 0.77 | ALDH1A1 (0.58) | SMN1; SMN2KDM4EALDH1A1POLBLMNA | |
| SCHEMBL2048248 | 0.76 | ADRB1 (0.53) | SMN1; SMN2ALDH1A1TSHRLMNAMAPT | |
| Hydrochloric Acid SCHEMBL10536215 | 0.76 | ADRB1 (0.50) | KDM4EALDH1A1TSHRPOLBLMNA | |
| SCHEMBL6914239 | 0.76 | AKR1C3 (0.46) | KDM4EALDH1A1POLBLMNAMAPT | |
| SCHEMBL23161511 | 0.74 | SMN1; SMN2 (0.56) | SMN1; SMN2KDM4EALDH1A1TSHRPOLB | |
| SCHEMBL3042980 | 0.74 | ALDH1A1 (0.56) | SMN1; SMN2KDM4EALDH1A1TSHRPOLB |
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-2638040-A1 | RADIOLABELLED mGLuR2 PET LIGANDS | Janssen Pharmaceuticals, Inc. (US) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012062752-A1 | RADIOLABELLED mGLuR2 PET LIGANDS | Janssen Pharmaceuticals, Inc. (US) | 2012-05-18 | — | — | WO | disclosed |