Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PI4KB | Q9UBF8 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3711114 | 0.90 | TSHR (0.44) | TSHRALDH1A1CYP1A2MEN1TP53 | |
| SCHEMBL3711117 | 0.84 | TSHR (0.43) | TSHRALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL3793749 | 0.84 | THRB (0.41) | TSHRALDH1A1CYP1A2KMT2AKDM4E | |
| SCHEMBL3706521 | 0.83 | RORC (0.53) | — | |
| SCHEMBL3701809 | 0.82 | THRB (0.40) | TSHRALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL3711993 | 0.82 | THRB (0.45) | TSHRLMNAMAPT | |
| SCHEMBL3707632 | 0.81 | THRA (0.40) | TSHRCYP1A2KMT2ACYP2C19SMN1; SMN2 | |
| SCHEMBL3227581 | 0.78 | ALDH1A1 (0.42) | TSHRALDH1A1MEN1GAAKMT2A | |
| SCHEMBL3705084 | 0.77 | TSHR (0.44) | TSHRALDH1A1MEN1GAAKMT2A | |
| SCHEMBL3709382 | 0.76 | RORC (0.51) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010086878-A2 | THYROID RECEPTOR MODULATORS | CADILA HEALTHCARE LIMITED (IN) | 2010-08-05 | — | — | WO | claimed |
| WO-2010086878-A2 | THYROID RECEPTOR MODULATORS | CADILA HEALTHCARE LIMITED (IN) | 2010-08-05 | — | — | WO | disclosed |