Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.36 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.35 |
| ▸ | CCNC | P24863 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7683073 | 0.77 | SMN1; SMN2 (0.51) | PBRM1SMN1; SMN2ALDH1A1L3MBTL1MAPT | |
| SCHEMBL280180 | 0.77 | PBRM1 (0.47) | PBRM1SMN1; SMN2ALDH1A1MEN1POLB | |
| Hydrochloric Acid SCHEMBL11460375 | 0.74 | PBRM1 (0.45) | PBRM1SMN1; SMN2ALDH1A1KMT2AMAPT | |
| SCHEMBL28196722 | 0.73 | SMN1; SMN2 (0.41) | PBRM1SMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL28196723 | 0.71 | SMN1; SMN2 (0.40) | SMN1; SMN2ALDH1A1MEN1POLBKMT2A | |
| SCHEMBL28009316 | 0.71 | SMN1; SMN2 (0.47) | PBRM1SMN1; SMN2ALDH1A1POLBKMT2A | |
| SCHEMBL28196167 | 0.70 | DHODH (0.41) | SMN1; SMN2ALDH1A1MEN1POLBKMT2A | |
| SCHEMBL29793896 | 0.67 | SMN1; SMN2 (0.41) | SMN1; SMN2ALDH1A1MEN1POLBKMT2A | |
| SCHEMBL7687945 | 0.67 | SMN1; SMN2 (0.56) | SMN1; SMN2MEN1KMT2AMAPTMDM2 | |
| SCHEMBL9432882 | 0.67 | SMN1; SMN2 (0.51) | SMN1; SMN2ALDH1A1KMT2AMAPTBACE1 |
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-105130872-B | Preparation method of 3-trifluoromethyl substituted indole | 江西师范大学 | 2018-01-30 | — | — | CN | disclosed |