Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.63 |
| ▸ | RAB9A | P51151 | 5/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.63 |
| ▸ | MAPT | P10636 | 4/20 | 0.63 |
| ▸ | TP53 | P04637 | 2/20 | 0.63 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.63 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.63 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | TGM2 | P21980 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.51 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6396790 | 0.89 | RAB9A (0.76) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL19825014 | 0.85 | TGM2 (0.61) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL19824964 | 0.85 | RAB9A (0.81) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL19825008 | 0.85 | RAB9A (0.81) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL18877602 | 0.83 | MTNR1B (0.61) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL14704205 | 0.82 | L3MBTL1 (0.58) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL9501086 | 0.80 | KDM4E (0.65) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL19825210 | 0.80 | NPC1 (0.54) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL18415556 | 0.79 | RAB9A (0.68) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL11721311 | 0.79 | RAB9A (0.68) | NPC1RAB9ASMN1; SMN2MAPTTP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018019774-A1 | AMIDE-BASED HOLE-TRANSPORTING OR HOLE-INJECTING MATERIALS | LUDWIG-MAXIMILIANS-UNIVERSITÄT MÜNCHEN (DE) | 2018-02-01 | — | — | WO | disclosed |
| EP-3275865-A1 | AMIDE-BASED HOLE-TRANSPORTING OR HOLE-INJECTING MATERIALS | Ludwig-Maximilians-Universität München (DE) | 2018-01-31 | — | — | EP | disclosed |