Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.42 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.42 |
| ▸ | ALOX5AP | P20292 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL921519 | 0.83 | S1PR4 (0.44) | NPC1RAB9AKMT2ARXFP1CA12 | |
| SCHEMBL509290 | 0.82 | ALDH1A1 (0.42) | KMT2ACA12CA1CA2CA7 | |
| SCHEMBL23507861 | 0.78 | NPC1 (0.44) | NPC1RAB9AKMT2ARXFP1CA12 | |
| SCHEMBL38656562 | 0.78 | CA12 (0.40) | NPC1RAB9AKMT2ACA12CA1 | |
| SCHEMBL38655981 | 0.78 | CA12 (0.40) | NPC1RAB9AKMT2ACA12CA1 | |
| SCHEMBL14337558 | 0.77 | CA12 (0.39) | NPC1RAB9AKMT2ACA12CA1 | |
| SCHEMBL22912507 | 0.73 | TDP1 (0.51) | RAB9AKMT2ASMN1; SMN2MAPTL3MBTL1 | |
| SCHEMBL16624267 | 0.73 | NPC1 (0.48) | NPC1RAB9AKMT2AMEN1RXFP1 | |
| SCHEMBL1550012 | 0.72 | RAB9A (0.49) | NPC1RAB9ASMN1; SMN2MAPTNFKB1 | |
| SCHEMBL2159976 | 0.72 | NPSR1 (0.42) | KMT2AMEN1CA12CA1CA2 |
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-103209962-B | As the 6-amino-nicotinamide of the replacement of KCNQ2/3 conditioning agent | GRUNENTHAL GMBH (DE) | 2016-03-02 | — | — | CN | disclosed |