Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 16/20 | 0.96 |
| ▸ | RAB9A | P51151 | 16/20 | 0.96 |
| ▸ | SMN1; SMN2 | Q16637 | 12/20 | 0.96 |
| ▸ | HPGD | P15428 | 8/20 | 0.96 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.96 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.96 |
| ▸ | RELA | Q04206 | 2/20 | 0.96 |
| ▸ | POLB | P06746 | 1/20 | 0.96 |
| ▸ | TSHR | P16473 | 3/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.66 |
| ▸ | MAPT | P10636 | 3/20 | 0.66 |
| ▸ | GLA | P06280 | 1/20 | 0.66 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL10038533 | 1.00 | NPC1 (0.96) | NPC1RAB9ASMN1; SMN2HPGDNFKB1 | |
| SCHEMBL14461284 | 1.00 | NPC1 (0.96) | NPC1RAB9ASMN1; SMN2HPGDNFKB1 | |
| SCHEMBL14818889 | 0.98 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2HPGDNFKB1 | |
| SCHEMBL762284 | 0.98 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2HPGDNFKB1 | |
| SCHEMBL13231671 | 0.91 | NPC1 (0.79) | NPC1RAB9ASMN1; SMN2HPGDNFKB1 | |
| SCHEMBL14461283 | 0.89 | NPC1 (0.77) | NPC1RAB9ASMN1; SMN2HPGDNFKB1 | |
| SCHEMBL13134518 | 0.89 | NPC1 (0.77) | NPC1RAB9ASMN1; SMN2HPGDNFKB1 | |
| SCHEMBL22858502 | 0.89 | NPC1 (0.90) | NPC1RAB9ASMN1; SMN2HPGDNFKB1 | |
| SCHEMBL46424 | 0.89 | NPC1 (0.90) | NPC1RAB9ASMN1; SMN2HPGDNFKB1 | |
| SCHEMBL120253 | 0.89 | NPC1 (0.83) | NPC1RAB9ASMN1; SMN2HPGDNFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2790239-B1 | MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT | IDEMITSU KOSAN CO (JP) | 2020-02-05 | — | — | EP | disclosed |