Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 6/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 2/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2058979 | 0.81 | CYP2C19 (0.64) | CYP2C19CNR2TSHRNR1H2NR1H3 | |
| SCHEMBL8013362 | 0.75 | TSHR (0.75) | CYP2C19CNR2TSHRNR1H2NR1H3 | |
| SCHEMBL2058932 | 0.74 | ALDH1A1 (0.50) | CYP2C19CNR2TSHRKMT2A | |
| SCHEMBL8017019 | 0.72 | INSR (0.54) | CYP2C19CNR2TSHRNR1H2NR1H3 | |
| SCHEMBL2960872 | 0.71 | CYP2C19 (0.78) | CYP2C19CNR2TSHRNR1H2NR1H3 | |
| SCHEMBL5537808 | 0.70 | NR1H2 (0.60) | CYP2C19CNR2TSHRNR1H2NR1H3 | |
| Hydrochloric Acid SCHEMBL2139953 | 0.69 | TSHR (0.71) | CYP2C19CNR2TSHRNR1H2NR1H3 | |
| SCHEMBL6680526 | 0.69 | CYP2C19 (0.68) | CYP2C19CNR2TSHRNR1H2NR1H3 | |
| SCHEMBL4407604 | 0.68 | CYP2C19 (0.67) | CYP2C19CNR2TSHRNR1H2NR1H3 | |
| SCHEMBL10763738 | 0.68 | CYP2C19 (0.67) | CYP2C19CNR2TSHRNR1H2NR1H3 |
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-6436904-B1 | TREATMENT OF INFLAMMATORY DISEASES IN MAMMALS | ELAN PHARMACEUTICALS, INC. | 2002-08-20 | — | — | US | claimed |