Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | PLA2G4B | P0C869 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 3/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16396138 | 0.92 | HTT (0.59) | HTTRAB9ASMN1; SMN2NPC1POLB | |
| SCHEMBL16396254 | 0.89 | RAB9A (0.60) | RAB9ASMN1; SMN2NPC1POLBPLA2G4B | |
| SCHEMBL417705 | 0.81 | MAPT (0.60) | HTTRAB9AMAPTALDH1A1MAOB | |
| SCHEMBL16396350 | 0.80 | MAOB (0.53) | RAB9ASMN1; SMN2NPC1POLBPLA2G4B | |
| SCHEMBL11265699 | 0.78 | MEN1 (0.70) | RAB9APLA2G4BMAPTALDH1A1MAOB | |
| SCHEMBL8403461 | 0.76 | ALDH1A1 (0.65) | HTTRAB9ASMN1; SMN2NPC1POLB | |
| SCHEMBL8561986 | 0.75 | KMT2A (0.55) | HTTRAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL1107602 | 0.74 | SMPD1 (0.56) | HTTRAB9ASMN1; SMN2NPC1POLB | |
| SCHEMBL1099548 | 0.73 | MEN1 (0.55) | HTTRAB9ASMN1; SMN2NPC1MAPT | |
| SCHEMBL6841271 | 0.72 | MAPT (0.53) | POLBMAPTALDH1A1MAOBMAOA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3004057-A1 | HETEROCYCLIC DERIVATIVES AND USE THEREOF | C&C Research Laboratories (KR) | 2016-04-13 | — | — | EP | disclosed |
| WO-2014196793-A1 | HETEROCYCLIC DERIVATIVES AND USE THEREOF | C&C RESEARCH LABORATORIES (KR) | 2014-12-11 | — | — | WO | disclosed |