Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16870944 | 0.80 | GPR3 (0.31) | — | |
| SCHEMBL19041704 | 0.80 | HPRT1 (0.32) | TSHRCYP1A2CYP2A6 | |
| SCHEMBL22186748 | 0.73 | TSHR (0.35) | TSHRCYP3A4HPGDMAPK1CASP1 | |
| SCHEMBL20205506 | 0.71 | GPR3 (0.35) | CYP1A2 | |
| SCHEMBL19545508 | 0.70 | ALDH1A1 (0.48) | TSHRCYP3A4HPGDMAPK1CASP1 | |
| SCHEMBL19545507 | 0.69 | PRNP (0.36) | TSHRHSD17B10CYP1A2CYP2A6 | |
| SCHEMBL19041703 | 0.69 | TNKS (0.32) | — | |
| SCHEMBL23442966 | 0.68 | HNF4A (0.38) | TSHRCYP3A4HPGDMAPK1CASP1 | |
| SCHEMBL23098891 | 0.68 | TSHR (0.37) | TSHRCYP3A4HPGDMAPK1CASP1 | |
| SCHEMBL22826281 | 0.67 | PRNP (0.33) | TSHRCYP3A4HPGDMAPK1CASP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017188597-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2017-11-02 | — | — | WO | disclosed |
| WO-2017111543-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2017-06-29 | — | — | WO | disclosed |