Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 3/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.32 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28647276 | 0.87 | ALDH1A1 (0.55) | ALDH1A1CYP3A4TSHRSLC22A1OPRM1 | |
| SCHEMBL13155100 | 0.87 | SIGMAR1 (0.44) | — | |
| SCHEMBL95074 | 0.84 | TSHR (0.42) | ALDH1A1TSHRSLC6A2SLC6A4GLA | |
| SCHEMBL39602 | 0.81 | ALDH1A1 (0.36) | ALDH1A1CYP3A4TSHRARGRIN1 | |
| SCHEMBL10690257 | 0.80 | ALDH1A1 (0.36) | ALDH1A1CYP3A4TSHRSLC22A1OPRM1 | |
| SCHEMBL28770249 | 0.77 | S1PR1 (0.34) | ALDH1A1CYP3A4TSHRARGLA | |
| SCHEMBL24300500 | 0.74 | ALDH1A1 (0.36) | ALDH1A1CYP3A4TSHRSLC6A2SLC6A4 | |
| SCHEMBL7201607 | 0.73 | LMNA (0.38) | ALDH1A1CYP3A4TSHRSLC6A2SLC6A4 | |
| SCHEMBL7002552 | 0.72 | ESRRG (0.43) | ALDH1A1CYP3A4TSHROPRM1HTR2C | |
| SCHEMBL20893275 | 0.72 | CHRNB2 (0.41) | ALDH1A1SLC6A2SLC6A4 |
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-20040156933-A1 | Polymer additives with improved permanence and surface affinity | CIBA SPECIALTY CHEMICALS CORP. | 2004-08-12 | — | — | US | disclosed |