Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPA5 | P11021 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 9/20 | 0.38 |
| ▸ | ESR1 | P03372 | 6/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.35 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8154668 | 0.93 | ESR2 (0.38) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4054377 | 0.92 | ESR2 (0.44) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8153644 | 0.89 | AMY1A (0.42) | HSPA5ESR2ESR1CYP3A4CYP2D6 | |
| SCHEMBL8141767 | 0.87 | NUDT1 (0.40) | HSPA5ESR2ESR1SLC5A1SLC5A2 | |
| SCHEMBL7772545 | 0.87 | SHBG (0.41) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8151074 | 0.86 | CYP26A1 (0.37) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8155473 | 0.84 | CYP19A1 (0.39) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8150655 | 0.83 | ESR2 (0.36) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8147859 | 0.81 | ESR2 (0.35) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8142469 | 0.81 | NUDT1 (0.39) | HSPA5ESR2ESR1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-6127087-A | COMPOSITION COMPRISING ALKALI-SOLUBLE RESIN, SPECIFIED QUINONEDIAZIDE COMPOUND | TOKYO OHKA KOGYO CO., LTD. (JP) | 2000-10-03 | — | — | US | disclosed |
| US-6106994-A | ESTERIFYING A POLYPHENOL COMPOUND AND NAPHTHOQUINONE-1,2-DIAZIDESULFONYL HALIDE IN THE PRESENCE OF FOR EXAMPLE MONOMETHYLDICYCLOHEXYLAMINE, AND POSITIVE PHOTOSENSITIVE COMPOSITION CONTAINS RESULTANT ESTER | TOKYO OHKA KOGYO CO., LTD. (JP) | 2000-08-22 | — | — | US | disclosed |