Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.58 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.52 |
| ▸ | ESR1 | P03372 | 7/20 | 0.52 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.52 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.48 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTR5A | P47898 | 1/20 | 0.44 |
| ▸ | CLK1 | P49759 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Naphthalene SCHEMBL27750041 | 0.94 | CYP1A2 (0.60) | CYP1A2CTDSP1ESR2ESR1MCL1 | |
| SCHEMBL29352754 | 0.94 | CTDSP1 (0.63) | CYP1A2CTDSP1ESR2ESR1MCL1 | |
| SCHEMBL29738648 | 0.94 | CTDSP1 (0.63) | CYP1A2CTDSP1ESR2ESR1MCL1 | |
| SCHEMBL29616 | 0.94 | CTDSP1 (0.63) | CYP1A2CTDSP1ESR2ESR1MCL1 | |
| Hydrogen Sulfide SCHEMBL8466036 | 0.91 | CTDSP1 (0.61) | CYP1A2CTDSP1ESR2ESR1MCL1 | |
| SCHEMBL8675127 | 0.90 | HSD17B1 (0.61) | CYP1A2CTDSP1ESR2ESR1MCL1 | |
| 1-Naphthol SCHEMBL28321946 | 0.90 | CYP1A2 (0.68) | CYP1A2CTDSP1ESR2ESR1MCL1 | |
| SCHEMBL8061629 | 0.87 | CYP1A2 (0.56) | CYP1A2CTDSP1ESR2ESR1HSD17B1 | |
| SCHEMBL8570092 | 0.86 | CYP1A2 (0.56) | CYP1A2CTDSP1ESR2ESR1HSD17B1 | |
| SCHEMBL8008479 | 0.86 | CYP1A2 (0.56) | CYP1A2CTDSP1ESR2ESR1HSD17B1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0610920-B1 | Method of preparing naphthol-modified phenolic resin and epoxy resin molding material for sealing electronic parts | HITACHI CHEMICAL CO LTD (JP) | 1998-04-29 | — | — | EP | disclosed |
| US-4146532-A | Fluoroelastomer composition with diazobicycloundecenium | DAIKIN KOGYO CO., LTD. (JP) | 1979-03-27 | — | — | US | disclosed |