Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.38 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.38 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.37 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10818255 | 0.85 | ALDH1A1 (0.46) | TSHRHSD17B10ALDH1A1KMT2AMAPT | |
| SCHEMBL9627350 | 0.75 | PTGS1 (0.40) | PTGS1CXCR1CXCR2GSTP1GSTM2 | |
| SCHEMBL970491 | 0.74 | PTGS1 (0.39) | PTGS1CXCR1CXCR2GSTP1GSTM2 | |
| SCHEMBL10404352 | 0.73 | SMN1; SMN2 (0.35) | ALDH1A1KMT2AMAPTLMNAHTT | |
| SCHEMBL16724105 | 0.73 | SMN1; SMN2 (0.41) | PTGS1CXCR1CXCR2GSTP1GSTM2 | |
| SCHEMBL21963005 | 0.70 | CCNE2 (0.44) | PTGS1CXCR1CXCR2GSTP1GSTM2 | |
| SCHEMBL10402932 | 0.69 | RPS6KA3 (0.33) | — | |
| SCHEMBL9097022 | 0.69 | CA2 (0.45) | PTGS1CXCR1CXCR2HSD17B10 | |
| SCHEMBL23569353 | 0.68 | CXCR1 (0.40) | PTGS1CXCR1CXCR2GSTP1GSTM2 | |
| SCHEMBL15315500 | 0.67 | RAB9A (0.46) | PTGS1CXCR1CXCR2TSHRHSD17B10 |
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-0104403-B1 | NEW METHOD FOR THE SYNTHESIS OF 5-THIO-1,2,3-THIADIAZOLE | AMERICAN CYANAMID COMPANY (US) | 1989-01-25 | — | — | EP | disclosed |
| US-4454336-A | Derivatives of 3-(formylmethylthio)-propanoate | AMERICAN CYANAMID COMPANY (US) | 1984-06-12 | — | — | US | disclosed |
| EP-0104403-A1 | New method for the synthesis of 5-thio-1,2,3-thiadiazole | AMERICAN CYANAMID COMPANY (US) | 1984-04-04 | — | — | EP | disclosed |