Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 5/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20404488 | 0.82 | CHRM3 (0.35) | CHRM3LMNAHSD17B10CHRM2CHRM4 | |
| SCHEMBL19265011 | 0.75 | CHRM3 (0.35) | CHRM3LMNAALDH1A1HSD17B10KDM4E | |
| SCHEMBL13677468 | 0.72 | CHRM3 (0.38) | CHRM3LMNAHSD17B10CHRM2CHRM4 | |
| SCHEMBL4593737 | 0.72 | CHRM3 (0.38) | CHRM3LMNAHSD17B10CHRM2CHRM4 | |
| SCHEMBL17264143 | 0.69 | OAT (0.38) | CHRM3LMNAALDH1A1HSD17B10KDM4E | |
| SCHEMBL8588994 | 0.69 | — | — | |
| SCHEMBL19204667 | 0.67 | PTPN1 (0.45) | CHRM3LMNAALDH1A1HSD17B10KDM4E | |
| SCHEMBL14259515 | 0.67 | CHRM3 (0.34) | CHRM3LMNAHSD17B10MAPTKMT2A | |
| SCHEMBL16092467 | 0.66 | KMT2A (0.37) | CHRM3LMNAALDH1A1KMT2ACHRM2 | |
| SCHEMBL20081657 | 0.66 | CHRM3 (0.33) | CHRM3LMNAHSD17B10CHRM2CHRM4 |
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-3112348-A1 | SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES | Tairx, Inc. (TW) | 2017-01-04 | — | — | EP | disclosed |
| US-8173045-B2 | Diels-Alder crosslinkable dendritic nonlinear optic chromophores and polymer composites | UNIVERSITY OF WASHINGTON (US) | 2012-05-08 | — | — | US | disclosed |