Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.45 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 5/20 | 0.43 |
| ▸ | REN | P00797 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1750533 | 0.90 | ERCC1 (0.46) | TSHRERCC1ERCC4SMN1; SMN2HPGD | |
| SCHEMBL1750880 | 0.82 | REN (0.42) | TSHRERCC1ERCC4HPGDLMNA | |
| SCHEMBL79109 | 0.82 | P2RX7 (0.50) | TSHRSMN1; SMN2HPGDP2RX7TRPV1 | |
| SCHEMBL1751252 | 0.82 | P2RX7 (0.41) | TSHRERCC1ERCC4SMN1; SMN2HPGD | |
| SCHEMBL2636014 | 0.81 | EPHX2 (0.47) | ERCC1ERCC4P2RX7RENCYP3A4 | |
| SCHEMBL2636015 | 0.80 | HSD11B1 (0.40) | TSHRERCC1ERCC4SMN1; SMN2HPGD | |
| SCHEMBL1751145 | 0.80 | TSHR (0.41) | TSHRERCC1ERCC4SMN1; SMN2HPGD | |
| SCHEMBL3079767 | 0.78 | TRPV1 (0.44) | SMN1; SMN2HPGDLMNARENCYP3A4 | |
| SCHEMBL5392945 | 0.77 | SMN1; SMN2 (0.64) | TSHRSMN1; SMN2HPGDLMNAALDH1A1 | |
| SCHEMBL1750408 | 0.77 | TSHR (0.50) | TSHRERCC1ERCC4SMN1; SMN2HPGD |
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-8129538-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-06 | — | — | US | disclosed |