Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | HTR3A | P46098 | 2/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | HTR3B | O95264 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11521525 | 0.85 | ALDH1A1 (0.46) | TSHRSMN1; SMN2CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL11518719 | 0.83 | ALDH1A1 (0.43) | TSHRSMN1; SMN2CYP1A2CYP2C19MCOLN3 | |
| SCHEMBL10691315 | 0.82 | ALDH1A1 (0.53) | TSHRSMN1; SMN2CYP1A2CYP2C19MCOLN3 | |
| SCHEMBL11519059 | 0.80 | TSHR (0.36) | TSHRSMN1; SMN2CYP1A2CYP2C19MCOLN3 | |
| SCHEMBL7221070 | 0.78 | MCOLN3 (0.45) | TSHRSMN1; SMN2CYP1A2CYP2C19MCOLN3 | |
| SCHEMBL10687962 | 0.77 | ALDH1A1 (0.47) | TSHRSMN1; SMN2CYP1A2CYP2C19MCOLN3 | |
| SCHEMBL11700687 | 0.77 | ALDH1A1 (0.50) | TSHRSMN1; SMN2CYP1A2CYP2C19MCOLN3 | |
| SCHEMBL8951874 | 0.76 | CA2 (0.39) | TSHRSMN1; SMN2CYP1A2ALDH1A1CYP2D6 | |
| SCHEMBL3844818 | 0.75 | VCAM1 (0.46) | SMN1; SMN2ALDH1A1KMT2ANPSR1 | |
| SCHEMBL11681244 | 0.74 | ALDH1A1 (0.42) | TSHRSMN1; SMN2CYP1A2CYP2C19MCOLN3 |
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-4754024-A | Fibre-reactive azo dyes containing vinylsulfonyl or analogous groups | CIBA-GEIGY CORPORATION | 1988-06-28 | — | — | US | disclosed |