Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17973779 | 0.94 | NPC1 (0.35) | HSD17B3NPC1RAB9ALMNAMAPK1 | |
| SCHEMBL17973778 | 0.92 | NPC1 (0.36) | HSD17B3NPC1RAB9ALMNAMAPK1 | |
| SCHEMBL17973783 | 0.88 | NPC1 (0.35) | NPC1RAB9ALMNAMAPK1CASP3 | |
| SCHEMBL17973768 | 0.87 | NPC1 (0.39) | NPC1RAB9ALMNAMAPK1CASP3 | |
| SCHEMBL17973757 | 0.87 | NPC1 (0.41) | NPC1RAB9ALMNAMAPK1CASP3 | |
| SCHEMBL17973742 | 0.87 | NPC1 (0.41) | NPC1RAB9ALMNAMAPK1CASP3 | |
| SCHEMBL17973749 | 0.85 | NPC1 (0.40) | NPC1RAB9ALMNAMAPK1CASP3 | |
| SCHEMBL17973759 | 0.85 | NPC1 (0.40) | NPC1RAB9ALMNAMAPK1CASP3 | |
| SCHEMBL17973769 | 0.84 | NPC1 (0.39) | NPC1RAB9ALMNAMAPK1CASP3 | |
| SCHEMBL17973739 | 0.84 | NPC1 (0.39) | NPC1RAB9ALMNAMAPK1CASP3 |
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 |
|---|---|---|---|---|---|---|---|
| US-20160225998-A1 | CHARGE-TRANSPORTING MATERIAL AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2016-08-04 | — | — | US | disclosed |