Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | NEU3 | Q9UQ49 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3932936 | 0.84 | TPMT (0.37) | TSHRMAPK1POLB | |
| SCHEMBL7158495 | 0.83 | TSHR (0.46) | TP53NEU3TSHRMAPK1CHEK1 | |
| SCHEMBL11297490 | 0.82 | POLB (0.34) | TP53PLAUMKNK2NEU3TSHR | |
| SCHEMBL3663229 | 0.76 | TSHR (0.46) | TSHRMAPK1POLB | |
| SCHEMBL3398797 | 0.76 | HPGD (0.37) | CHEK1CA2POLB | |
| SCHEMBL9787517 | 0.76 | LMNA (0.35) | NEU3BRD4POLB | |
| SCHEMBL8359643 | 0.75 | LMNA (0.47) | TSHRMAPK1POLB | |
| SCHEMBL9787542 | 0.75 | HDAC8 (0.37) | TP53TSHREGFRHDAC8HDAC6 | |
| SCHEMBL9451092 | 0.75 | POLB (0.32) | TSHRMAPK1POLB | |
| SCHEMBL29423654 | 0.75 | POLB (0.32) | TSHRMAPK1POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0558484-A1 | NOVEL X-RAY CONTRAST AGENTS, COMPOSITIONS AND METHODS | MALLINCKRODT MEDICAL, INC. (US) | 1993-09-08 | — | — | EP | claimed |
| WO-1992009562-A1 | NOVEL X-RAY CONTRAST AGENTS, COMPOSITIONS AND METHODS | MALLINCKRODT MEDICAL, INC. (US) | 1992-06-11 | — | — | WO | claimed |
| US-5356613-A | X-ray contrast agents, compositions and methods | MALLINCKRODT MEDICAL, INC. (US) | 1994-10-18 | — | — | US | disclosed |