Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 13/20 | 0.41 |
| ▸ | RAB9A | P51151 | 13/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.38 |
| ▸ | RELA | Q04206 | 2/20 | 0.38 |
| ▸ | MECP2 | P51608 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL17033586 | 0.84 | ALDH1A1 (0.39) | SMN1; SMN2HPGDKDM4EALDH1A1TSHR | |
| SCHEMBL17033449 | 0.84 | KDM4E (0.38) | HPGDKDM4EALDH1A1TSHRMEN1 | |
| SCHEMBL17033438 | 0.83 | L3MBTL1 (0.37) | HPGDKDM4EALDH1A1TSHRMEN1 | |
| SCHEMBL29374218 | 0.81 | NPC1 (0.57) | NPC1RAB9ASMN1; SMN2HPGDKDM4E | |
| SCHEMBL404737 | 0.81 | NPC1 (0.57) | NPC1RAB9ASMN1; SMN2HPGDKDM4E | |
| SCHEMBL17033811 | 0.80 | NPC1 (0.38) | NPC1RAB9ASMN1; SMN2HPGDKDM4E | |
| SCHEMBL10299032 | 0.80 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2HPGDKDM4E | |
| SCHEMBL17614166 | 0.80 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2HPGDKDM4E | |
| SCHEMBL17033441 | 0.80 | KDM4E (0.34) | HPGDKDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL10064983 | 0.79 | NPC1 (0.55) | NPC1RAB9ASMN1; SMN2HPGDKDM4E |
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-2015125986-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2015-08-27 | — | — | WO | disclosed |