Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ICAM1 | P05362 | 5/20 | 0.54 |
| ▸ | SELE | P16581 | 5/20 | 0.54 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.54 |
| ▸ | PRNP | P04156 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.43 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | CSNK1D | P48730 | 3/20 | 0.41 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.39 |
| ▸ | CISD2 | Q8N5K1 | 1/20 | 0.39 |
| ▸ | GAK | O14976 | 1/20 | 0.38 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.38 |
| ▸ | STK16 | O75716 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10745539 | 0.88 | CSNK1D (0.41) | ICAM1SELEVCAM1NPSR1CSNK1D | |
| SCHEMBL10741832 | 0.86 | CFTR (0.46) | ICAM1SELEVCAM1MAPK1NPSR1 | |
| SCHEMBL8442991 | 0.81 | ICAM1 (0.77) | ICAM1SELEVCAM1PRNPTSHR | |
| SCHEMBL9857130 | 0.80 | ICAM1 (0.41) | ICAM1SELEVCAM1DYRK1AKDM4E | |
| SCHEMBL9857920 | 0.77 | SENP5 (0.38) | ICAM1SELEVCAM1HTTGAK | |
| SCHEMBL693963 | 0.77 | CYP2C19 (0.41) | PRNPTSHRMAPK1PPARGHTT | |
| SCHEMBL692750 | 0.76 | CSNK1D (0.41) | PRNPTSHRMAPK1PPARGHTT | |
| SCHEMBL15697523 | 0.76 | ALDH1A1 (0.59) | MAPK1HTTNPSR1CFTRCISD2 | |
| SCHEMBL693546 | 0.76 | ALDH1A1 (0.47) | MAPK1MAPK10NPSR1CSNK1DCFTR | |
| SCHEMBL15698889 | 0.75 | CFTR (0.43) | MAPK1MAPK10NPSR1CSNK1DCFTR |
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 |
|---|---|---|---|---|---|---|---|
| US-5068248-A | Analgesics, antipyretics and antiinflammatory agents | MERCK & CO., INC. (US) | 1991-11-26 | — | — | US | disclosed |
| EP-0160408-B1 | BENZOTHIOPHENES, THEIR PRODUCTION AND USE, AND COMPOSITIONS CONTAINING THEM | MERCK & CO. INC. (US) | 1989-08-23 | — | — | EP | disclosed |
| US-4760086-A | N-alkenyl-3-hydroxybenzo[b]thiophene-2-carboxamide derivatives as dual cyclooxygenase and lipoxygenase inhibitors | MERCK & CO., INC. (US) | 1988-07-26 | — | — | US | disclosed |
| EP-0160408-A1 | Benzothiophenes, their production and use, and compositions containing them | MERCK & CO. INC. (US) | 1985-11-06 | — | — | EP | disclosed |