Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.57 |
| ▸ | S100A4 | P26447 | 2/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 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 | |
|---|---|---|---|---|
| SCHEMBL1999472 | 0.91 | ALDH1A1 (0.69) | ALDH1A1TDP1S100A4PTPRCKMT2A | |
| SCHEMBL29565552 | 0.78 | ALDH1A1 (0.56) | ALDH1A1TDP1S100A4PTPRCKMT2A | |
| SCHEMBL26164145 | 0.78 | ALDH1A1 (0.56) | ALDH1A1TDP1S100A4PTPRCKMT2A | |
| SCHEMBL9760964 | 0.77 | ALDH1A1 (0.81) | ALDH1A1TDP1S100A4PTPRCKMT2A | |
| SCHEMBL11617176 | 0.77 | TDP1 (0.57) | ALDH1A1TDP1S100A4PTPRCKMT2A | |
| Isothiocyanate SCHEMBL29287690 | 0.76 | ALDH1A1 (0.49) | ALDH1A1TDP1S100A4PTPRCKMT2A | |
| SCHEMBL14956663 | 0.75 | VCAM1 (0.47) | ALDH1A1TDP1S100A4PTPRCKMT2A | |
| SCHEMBL29180134 | 0.75 | ALDH1A1 (0.92) | ALDH1A1TDP1S100A4PTPRCKMT2A | |
| SCHEMBL30196067 | 0.74 | ALDH1A1 (1.00) | ALDH1A1TDP1S100A4PTPRCKMT2A | |
| SCHEMBL44392 | 0.74 | ALDH1A1 (1.00) | ALDH1A1TDP1S100A4PTPRCKMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103965134-B | It is a kind of to contain N, S heterocyclic compound and its preparation method and purposes with eelworm-killing activity | 华东理工大学 | 2019-02-05 | — | — | CN | disclosed |