Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | F12 | P00748 | 1/20 | 0.33 |
| ▸ | F7 | P08709 | 1/20 | 0.33 |
| ▸ | F3 | P13726 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL10042500 | 0.84 | DHODH (0.38) | PRSS1PRSS2PRSS3GRIN1GRIN2B | |
| SCHEMBL12801669 | 0.84 | MASP2 (0.35) | POLBF2MAPTTDP1L3MBTL1 | |
| SCHEMBL12655080 | 0.83 | OPRM1 (0.31) | CYP2C19CYP3A4MAPTTDP1L3MBTL1 | |
| SCHEMBL12435375 | 0.77 | ESR1 (0.34) | ESR1BLMPOLBCYP2C19RECQL | |
| SCHEMBL18792258 | 0.72 | AKT1 (0.38) | AKT1TSHRTDP1ALDH1A1 | |
| SCHEMBL12801196 | 0.72 | ALDH1A1 (0.45) | POLBCYP2C19KMT2ACYP3A4MAPT | |
| SCHEMBL19085533 | 0.70 | AKT1 (0.36) | AKT1 | |
| SCHEMBL6295220 | 0.70 | AKT1 (0.43) | AKT1BLMPOLBCYP2C19RECQL | |
| SCHEMBL16934148 | 0.70 | AKT1 (0.43) | AKT1KMT2ATSHRTDP1MEN1 | |
| SCHEMBL13799193 | 0.69 | AKT1 (0.35) | ESR1AKT1BLMPOLBCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011136483-A1 | NOVEL COMPOUNDS FOR ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2011-11-03 | — | — | WO | disclosed |