Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UGT2B7 | P16662 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28166206 | 0.85 | UGT2B7 (0.41) | UGT2B7LMNATRPA1PTGS1CACNA1C | |
| SCHEMBL27890619 | 0.81 | UGT2B7 (0.37) | UGT2B7HIF1AMEN1KMT2AAOC3 | |
| SCHEMBL22418999 | 0.74 | UGT2B7 (0.42) | UGT2B7LMNAHIF1AMEN1KMT2A | |
| SCHEMBL645977 | 0.74 | CYP2A6 (0.48) | LMNAALDH1A1GAACYP1A2SMN1; SMN2 | |
| SCHEMBL2318276 | 0.73 | ESR1 (0.35) | CYP1A2CYP2D6NPC1RAB9ACA1 | |
| Naphthalene SCHEMBL9636781 | 0.72 | UGT2B7 (0.71) | UGT2B7HIF1AMEN1KMT2AAOC3 | |
| SCHEMBL29555341 | 0.72 | UGT2B7 (0.71) | UGT2B7HIF1AMEN1KMT2AAOC3 | |
| SCHEMBL9179436 | 0.72 | UGT2B7 (0.71) | UGT2B7HIF1AMEN1KMT2AAOC3 | |
| Naphthalene SCHEMBL29078859 | 0.72 | UGT2B7 (0.71) | UGT2B7HIF1AMEN1KMT2AAOC3 | |
| SCHEMBL599956 | 0.72 | UGT2B7 (0.71) | UGT2B7HIF1AMEN1KMT2AAOC3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107085033-A | N phenylnaphthalenes aminated compounds as MALDI matrix application | 中国科学院化学研究所 | 2017-08-22 | — | — | CN | disclosed |
| WO-2001027127-A1 | TAMOXIFEN AND TAMOXIFEN ANALOGUE GLYCOSIDES AND USES THEREOF | STRAKAN GROUP PLC (GB) | 2001-04-19 | — | — | WO | disclosed |
| WO-2001027129-A1 | GLYCOSIDES AND ORTHOESTER GLYCOSIDES OF RALOXIFENE AND ANALOGUES AND THE USE THEREOF | STRAKAN LIMITED (BM) | 2001-04-19 | — | — | WO | disclosed |