Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.60 |
| ▸ | RAB9A | P51151 | 8/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.56 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | APP | P05067 | 2/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.50 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.50 |
| ▸ | PRKCG | P05129 | 1/20 | 0.50 |
| ▸ | LYN | P07948 | 1/20 | 0.50 |
| ▸ | PRKACA | P17612 | 1/20 | 0.50 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.50 |
| ▸ | AKT1 | P31749 | 1/20 | 0.50 |
| ▸ | FLT3 | P36888 | 1/20 | 0.50 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.50 |
| ▸ | CLK2 | P49760 | 1/20 | 0.50 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.50 |
| ▸ | PRKX | P51817 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL27834923 | 0.84 | NPC1 (0.68) | NPC1RAB9AKMT2AMEN1PTGS1 | |
| SCHEMBL1913680 | 0.84 | NPC1 (0.71) | NPC1RAB9AKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL28147052 | 0.83 | CSNK1D (0.64) | NPC1RAB9AKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL27834959 | 0.82 | DYRK1A (0.64) | NPC1RAB9AKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL4279159 | 0.80 | ROCK2 (0.77) | RAB9AROCK2MAP4K4PRKCGLYN | |
| SCHEMBL4286925 | 0.80 | ROCK2 (0.63) | NPC1RAB9AROCK2MAP4K4PRKCG | |
| SCHEMBL28147012 | 0.80 | RAB9A (0.71) | NPC1RAB9AKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL9335490 | 0.79 | RAB9A (0.50) | NPC1RAB9AKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL4278562 | 0.79 | CLK4 (0.60) | NPC1RAB9ASMN1; SMN2ROCK2MAP4K4 | |
| SCHEMBL4291617 | 0.79 | CLK4 (0.57) | RAB9AROCK2MAP4K4PRKCGLYN |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106565631-B | A kind of method that heteroaryl amine reacts synthesis substitution heteroaryl amine with amine | 温州大学 | 2018-11-30 | — | — | CN | disclosed |
| CN-106565631-A | Method for synthesizing substituent miscellaneous aromatic amine through reaction between miscellaneous aromatic amine and amine | 温州大学 | 2017-04-19 | — | — | CN | disclosed |