Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GRM7 | Q14831 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL493316 | 0.83 | TSHR (0.42) | TSHRSMN1; SMN2CYP3A4CYP2C19EPHX1 | |
| SCHEMBL2308758 | 0.81 | TSHR (0.47) | TSHRSMN1; SMN2GRM7CYP3A4CYP2C19 | |
| SCHEMBL28810401 | 0.81 | TSHR (0.48) | TSHRCYP3A4CYP2C19KDM1AEPHX1 | |
| Hydrochloric Acid SCHEMBL1327186 | 0.81 | TSHR (0.46) | TSHRSMN1; SMN2GRM7CYP3A4CYP2C19 | |
| SCHEMBL493817 | 0.81 | CYP3A4 (0.46) | TSHRSMN1; SMN2CYP3A4CYP2C19HPGD | |
| Cyclohexane SCHEMBL2304945 | 0.80 | TSHR (0.50) | TSHRSMN1; SMN2CYP3A4CYP2C19EPHX1 | |
| Cyclopentane SCHEMBL2306640 | 0.80 | TSHR (0.50) | TSHRSMN1; SMN2CYP3A4CYP2C19EPHX1 | |
| SCHEMBL1328352 | 0.80 | TSHR (0.45) | TSHRSMN1; SMN2LMNA | |
| SCHEMBL493318 | 0.79 | CYP3A4 (0.47) | TSHRSMN1; SMN2CYP3A4CYP2C19LMNA | |
| SCHEMBL2307354 | 0.79 | MEN1 (0.52) | SMN1; SMN2LMNARAB9AMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8106055-B2 | Substituted amide compounds | GRUENENTHAL GMBH (DE) | 2012-01-31 | — | — | US | disclosed |