Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 3/20 | 0.57 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.57 |
| ▸ | MMP12 | P39900 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.52 |
| ▸ | PGR | P06401 | 1/20 | 0.52 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.52 |
| ▸ | AR | P10275 | 1/20 | 0.52 |
| ▸ | THRA | P10827 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL7332798 | 0.88 | TAAR1 (0.57) | FFAR1FFAR4ESR1NR3C1PGR | |
| SCHEMBL6586 | 0.86 | FFAR1 (0.68) | FFAR1FFAR4ESR1NR3C1PGR | |
| SCHEMBL7511993 | 0.80 | ALDH1A1 (0.60) | FFAR1FFAR4MMP12THRATHRB | |
| SCHEMBL7511756 | 0.80 | MMP12 (0.54) | FFAR1MMP12ALDH1A1MAPTKEAP1 | |
| SCHEMBL7507038 | 0.80 | MMP12 (0.54) | FFAR1MMP12ALDH1A1KEAP1PTPRB | |
| SCHEMBL24242154 | 0.80 | IAPP (0.57) | FFAR1FFAR4ESR1NR3C1PGR | |
| SCHEMBL7507667 | 0.80 | MMP12 (0.54) | FFAR1FFAR4MMP12NR3C2THRA | |
| SCHEMBL26343023 | 0.80 | FFAR1 (0.57) | FFAR1MMP12NR3C2TAAR1RAB9A | |
| SCHEMBL1532408 | 0.80 | MMP12 (0.79) | FFAR1FFAR4MMP12ALDH1A1MAPT | |
| SCHEMBL1445967 | 0.79 | HDAC3 (0.63) | FFAR1FFAR4ESR1NR3C1PGR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107922394-A | 3 tetrazole radical benzene, 1,2 disulfonic acid amide derivative as metal beta lactamase restrainer | 默沙东公司 | 2018-04-17 | — | — | CN | disclosed |