Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NAT1 | P18440 | 2/20 | 0.43 |
| ▸ | GPR39 | O43194 | 1/20 | 0.42 |
| ▸ | PGR | P06401 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24309475 | 1.00 | TSHR (0.48) | TSHRSMN1; SMN2NAT1GPR39PGR | |
| SCHEMBL26810957 | 0.85 | TSHR (0.54) | TSHRSMN1; SMN2NAT1GPR39PGR | |
| SCHEMBL26811084 | 0.84 | MAPT (0.50) | TSHRSMN1; SMN2NAT1GPR39PGR | |
| SCHEMBL26810948 | 0.83 | TSHR (0.55) | TSHRSMN1; SMN2NAT1GPR39PGR | |
| SCHEMBL26811062 | 0.83 | TSHR (0.45) | TSHRSMN1; SMN2NAT1GPR39PGR | |
| SCHEMBL26810953 | 0.83 | TSHR (0.48) | TSHRSMN1; SMN2NAT1GPR39PGR | |
| SCHEMBL26810785 | 0.83 | TSHR (0.48) | TSHRSMN1; SMN2NAT1GPR39PGR | |
| SCHEMBL26811053 | 0.82 | TSHR (0.48) | TSHRSMN1; SMN2NAT1GPR39PGR | |
| SCHEMBL24309472 | 0.82 | SMN1; SMN2 (0.48) | TSHRSMN1; SMN2NAT1GPR39PGR | |
| SCHEMBL26810864 | 0.82 | TSHR (0.48) | TSHRSMN1; SMN2NAT1GPR39PGR |
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-4225748-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |