Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| Guanidinoethyldisulfide SCHEMBL145590 | 0.84 | TSHR (0.69) | TSHRHIF1AMEN1CYP1A2KMT2A | |
| Guanidinoethyldisulfide SCHEMBL1321518 | 0.81 | TSHR (0.67) | TSHRHIF1AMEN1CYP1A2KMT2A | |
| SCHEMBL12040362 | 0.76 | TSHR (0.60) | TSHRHIF1AMEN1CYP1A2KMT2A | |
| SCHEMBL13035000 | 0.74 | TSHR (0.58) | TSHRHIF1AMEN1CYP1A2KMT2A | |
| SCHEMBL17029960 | 0.73 | — | — | |
| SCHEMBL14215853 | 0.71 | TSHR (0.55) | TSHRHIF1AMEN1CYP1A2KMT2A | |
| SCHEMBL120583 | 0.70 | — | — | |
| SCHEMBL7063396 | 0.70 | — | — | |
| SCHEMBL10311296 | 0.70 | TSHR (0.53) | TSHRHIF1AMEN1CYP1A2KMT2A | |
| SCHEMBL3079040 | 0.69 | CYP1A2 (0.48) | TSHRHIF1AMEN1CYP1A2KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0814792-B1 | MERCAPTO AND SELENO DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | CHILDRENS HOSP MEDICAL CENTER (US) | 2003-05-28 | — | — | EP | disclosed |
| US-5985917-A | ANTITUMOR AGENTS AND ENZYME INHIBITORS | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1999-11-16 | — | — | US | disclosed |
| US-5929063-A | SELECTIVELY INHIBITS THE INDUCIBLE ISOFORM TO PREVENT OVER-INHIBITION; FOR DISORDERS WHERE THE ENZYME PLAYS A ROLE, E.G SYSTEMIC HYPOTENSION, SEPTIC SHOCK AND CYTOKINE THERAPY | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1999-07-27 | — | — | US | disclosed |
| WO-1997045108-A1 | GUANIDINO DERIVATIVES AS INHIBITORS OF THE CYTOTOXIC EFFECT OF PEROXYNITRITE | CHILDREN'S HOSPITAL MEDICAL CENTER (US) | 1997-12-04 | — | — | WO | disclosed |