Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | PGR | P06401 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24310498 | 1.00 | TSHR (0.44) | TSHRSMN1; SMN2ALDH1A1PGRGAA | |
| SCHEMBL26807481 | 0.89 | HTR1A (0.39) | TSHRSMN1; SMN2ALDH1A1MAPTCYP1A2 | |
| SCHEMBL26807604 | 0.89 | TSHR (0.43) | TSHRSMN1; SMN2ALDH1A1GAAPKM | |
| SCHEMBL26807608 | 0.87 | HTR6 (0.45) | TSHRSMN1; SMN2LMNAMAPTHTR1A | |
| SCHEMBL26807606 | 0.85 | HRH3 (0.40) | TSHRSMN1; SMN2ALDH1A1PKMKDM4E | |
| SCHEMBL29566782 | 0.82 | TSHR (0.46) | TSHRSMN1; SMN2ALDH1A1PGRGAA | |
| SCHEMBL24309955 | 0.82 | TSHR (0.46) | TSHRSMN1; SMN2ALDH1A1PGRGAA | |
| SCHEMBL26811034 | 0.82 | TSHR (0.47) | TSHRSMN1; SMN2ALDH1A1PGRGAA | |
| SCHEMBL24310502 | 0.81 | GPR39 (0.35) | HPGDMAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL26811032 | 0.81 | TSHR (0.50) | TSHRSMN1; SMN2ALDH1A1PGRGAA |
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 |