Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL477423 | 0.79 | HDAC4 (0.38) | TSHRCYP2C19HDAC4 | |
| Hydrochloric Acid SCHEMBL4731891 | 0.77 | HDAC4 (0.37) | TSHRCYP2C19HDAC4 | |
| SCHEMBL14949532 | 0.75 | P2RX7 (0.36) | — | |
| SCHEMBL15062781 | 0.75 | ALDH1A1 (0.39) | TSHRCYP2C19HDAC4 | |
| SCHEMBL21242398 | 0.73 | HTT (0.40) | TSHRCYP2C19 | |
| SCHEMBL15232657 | 0.72 | — | — | |
| SCHEMBL3903447 | 0.70 | DGAT1 (0.41) | TSHRCYP2C19HDAC4 | |
| SCHEMBL2480644 | 0.70 | NPSR1 (0.36) | TSHRCYP2C19 | |
| SCHEMBL22302657 | 0.68 | ALDH1A1 (0.32) | TSHRCYP2C19 | |
| SCHEMBL21380367 | 0.67 | DGAT1 (0.43) | TSHRHDAC4 |
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-8445501-B2 | Substituted 7-carboxamido-pyrrolo[3,2-d]pyrimidines | TAKEDA GMBH (DE) | 2013-05-21 | — | — | US | disclosed |