Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.32 |
| ▸ | NCOR2 | Q9Y618 | 7/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.32 |
| ▸ | STAT3 | P40763 | 1/20 | 0.31 |
| ▸ | LTA4H | P09960 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28376874 | 1.00 | NPC1 (0.35) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL20764438 | 0.92 | POLB (0.37) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL20764441 | 0.92 | POLB (0.37) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL28372338 | 0.87 | USP30 (0.33) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL20786871 | 0.79 | NPC1 (0.39) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL22076699 | 0.79 | POLB (0.34) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL22076701 | 0.79 | POLB (0.34) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL22076741 | 0.77 | CD40 (0.40) | NPC1RAB9APOLBMAPTMEN1 | |
| SCHEMBL22076742 | 0.77 | CD40 (0.40) | NPC1RAB9APOLBMAPTMEN1 | |
| SCHEMBL22076728 | 0.77 | CD40 (0.39) | NPC1RAB9ASMN1; SMN2POLBMAPT |
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-110997627-A | Novel cystobacter amide derivatives | 亥姆霍兹感染研究中心有限公司 | 2020-04-10 | — | — | CN | disclosed |