Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 6/20 | 0.57 |
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.57 |
| ▸ | MMP1 | P03956 | 2/20 | 0.48 |
| ▸ | MMP2 | P08253 | 2/20 | 0.48 |
| ▸ | MMP9 | P14780 | 2/20 | 0.48 |
| ▸ | MMP8 | P22894 | 2/20 | 0.48 |
| ▸ | MMP14 | P50281 | 2/20 | 0.48 |
| ▸ | BMP1 | P13497 | 2/20 | 0.47 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | MMP3 | P08254 | 1/20 | 0.45 |
| ▸ | MMP13 | P45452 | 1/20 | 0.45 |
| ▸ | MMP16 | P51512 | 1/20 | 0.45 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8606884 | 1.00 | KEAP1 (0.57) | KEAP1NFE2L2MMP1MMP2MMP9 | |
| SCHEMBL8606887 | 1.00 | KEAP1 (0.57) | KEAP1NFE2L2MMP1MMP2MMP9 | |
| SCHEMBL8448553 | 0.92 | KEAP1 (0.50) | KEAP1NFE2L2MMP1MMP2MMP9 | |
| SCHEMBL8606026 | 0.86 | KEAP1 (0.51) | KEAP1NFE2L2BMP1 | |
| SCHEMBL19471016 | 0.81 | DAGLA (0.70) | KEAP1NFE2L2MMP1MMP2MMP9 | |
| SCHEMBL17674720 | 0.81 | DAGLA (0.70) | KEAP1NFE2L2MMP1MMP2MMP9 | |
| SCHEMBL11470887 | 0.79 | KEAP1 (0.52) | KEAP1NFE2L2MMP1MMP2MMP9 | |
| SCHEMBL25269782 | 0.78 | BMP1 (0.59) | KEAP1NFE2L2BMP1 | |
| SCHEMBL25218426 | 0.78 | BMP1 (0.59) | KEAP1NFE2L2BMP1 | |
| SCHEMBL10911759 | 0.78 | AGER (0.59) | KEAP1NFE2L2MMP1MMP2MMP9 |
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-0830351-A1 | PROCESS FOR PREPARING SUBSTITUTED POLYAZAMACROCYCLES | MONSANTO COMPANY (US) | 1998-03-25 | — | — | EP | disclosed |
| US-5721361-A | CONTACTING A DIAMINE OR TRIAMINE AND A DICARBOXYLIC ACID OR ESTER IN THE PRESENCE OF A BASE AND SOLVENT; COUPLING AGENT; REDUCTION; COMPLEXING WITH MANGANESE COMPOUNDS; ION EXCHANGING | THE MONSANTO COMPANY (US) | 1998-02-24 | — | — | US | disclosed |
| WO-1996040658-A1 | PROCESS FOR PREPARING SUBSTITUTED POLYAZAMACROCYCLES | MONSANTO COMPANY (US) | 1996-12-19 | — | — | WO | disclosed |