Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 7/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.47 |
| ▸ | TSHR | P16473 | 7/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | AHR | P35869 | 8/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Pentachlorobenzene SCHEMBL11455164 | 0.72 | CYP3A4 (1.00) | CYP3A4HPGDHSD17B10TSHRCASP1 | |
| Pentachlorobenzene SCHEMBL183144 | 0.72 | CYP3A4 (1.00) | CYP3A4HPGDHSD17B10TSHRCASP1 | |
| SCHEMBL5538140 | 0.71 | ALDH1A1 (0.53) | CYP3A4HPGDHSD17B10TSHRCASP1 | |
| SCHEMBL11328451 | 0.71 | CYP3A4 (0.47) | CYP3A4HPGDHSD17B10TSHRCASP1 | |
| SCHEMBL4452692 | 0.69 | CYP3A4 (0.64) | CYP3A4HPGDHSD17B10TSHRCASP1 | |
| Pentachlorobenzene SCHEMBL29897265 | 0.69 | CYP3A4 (0.92) | CYP3A4HPGDHSD17B10TSHRCASP1 | |
| Pentachlorobenzene SCHEMBL1445743 | 0.69 | CYP3A4 (0.92) | CYP3A4HPGDHSD17B10TSHRCASP1 | |
| Pentachlorobenzene SCHEMBL27699552 | 0.69 | CYP3A4 (0.92) | CYP3A4HPGDHSD17B10TSHRCASP1 | |
| Pentachlorobenzene SCHEMBL27458674 | 0.69 | CYP3A4 (0.92) | CYP3A4HPGDHSD17B10TSHRCASP1 | |
| Pentachlorobenzene SCHEMBL27484054 | 0.69 | CYP3A4 (0.92) | CYP3A4HPGDHSD17B10TSHRCASP1 |
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-0833203-B1 | Anthraquinone compounds | NIPPON CATALYTIC CHEM IND (JP) | 2004-06-16 | — | — | EP | disclosed |
| US-5968688-A | RESINS AND DYES FOR COLOR FILTERS | NIPPON SHOKUBAI CO., LTD. (JP) | 1999-10-19 | — | — | US | disclosed |
| EP-0833203-A1 | Color filter grade photosensitive resin coloring composition, and color filter using the same | NIPPON SHOKUBAI CO., LTD. (JP) | 1998-04-01 | — | — | EP | disclosed |