Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19011050 | 1.00 | NPC1 (0.47) | NPC1RAB9AKMT2ARXFP1L3MBTL1 | |
| SCHEMBL19011052 | 0.88 | NPC1 (0.43) | NPC1RAB9AKMT2ARXFP1L3MBTL1 | |
| SCHEMBL19011058 | 0.88 | NPC1 (0.43) | NPC1RAB9AKMT2ARXFP1L3MBTL1 | |
| SCHEMBL25680335 | 0.87 | L3MBTL1 (0.52) | NPC1RAB9AKMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL19001662 | 0.85 | NPC1 (0.50) | NPC1RAB9AKMT2ARXFP1L3MBTL1 | |
| SCHEMBL19001660 | 0.85 | RXFP1 (0.48) | NPC1RAB9AKMT2ARXFP1L3MBTL1 | |
| SCHEMBL19011061 | 0.85 | FGFR1 (0.39) | NPC1RAB9AKMT2ARXFP1L3MBTL1 | |
| SCHEMBL16807310 | 0.82 | RXFP1 (0.39) | NPC1RAB9AKMT2ARXFP1L3MBTL1 | |
| SCHEMBL19011082 | 0.82 | KDM4E (0.49) | KMT2ARXFP1L3MBTL1ALDH1A1KDM4E | |
| SCHEMBL19011084 | 0.82 | KDM4E (0.46) | KMT2ARXFP1L3MBTL1ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017102064-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2017-06-22 | — | — | WO | disclosed |