Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | APEX1 | P27695 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1548068 | 0.83 | CA1 (0.33) | ESR1TRPA1 | |
| SCHEMBL23492884 | 0.77 | ESR1 (0.33) | ADRB2KDM4EMAPTAPEX1RECQL | |
| SCHEMBL12716286 | 0.74 | RAPGEF4 (0.32) | — | |
| SCHEMBL6231388 | 0.74 | PGAM1 (0.40) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| SCHEMBL8792389 | 0.73 | TRPV4 (0.30) | — | |
| SCHEMBL19115496 | 0.73 | ESR1 (0.42) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| SCHEMBL25216161 | 0.73 | TRPA1 (0.30) | TRPA1 | |
| SCHEMBL21883580 | 0.72 | HPGD (0.41) | ADRA2AADRA2CADRA1ACYP3A4HSD17B10 | |
| SCHEMBL24749310 | 0.71 | MAPK1 (0.36) | ADRA2AADRA2BADRA2CADRA1AADRB2 | |
| SCHEMBL6233326 | 0.71 | HTT (0.50) | CYP3A4KDM4EMAPTTDP1NPSR1 |
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-5759956-A | PYRAZINE CARBOXAMIDE DERIVATIVES | AMERICAN CYANAMID COMPANY (US) | 1998-06-02 | — | — | US | disclosed |
| EP-0700391-A1 | HERBICIDAL COMPOUNDS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1996-03-13 | — | — | EP | disclosed |
| WO-1994027974-A1 | HERBICIDAL COMPOUNDS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1994-12-08 | — | — | WO | disclosed |
| EP-0038186-A2 | Perfluoroamides of diaryl esters of N-phosphonomethylglycinonitrile, herbicidal compositions and herbicidal use thereof | MONSANTO COMPANY (US) | 1981-10-21 | — | — | EP | disclosed |