Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 6/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 6/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.37 |
| ▸ | CYP21A2 | P08686 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | NTSR1 | P30989 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16563220 | 0.84 | NPC1 (0.51) | CYP17A1CYP11B1CYP11B2CYP3A4CYP19A1 | |
| SCHEMBL28925264 | 0.76 | NPC1 (0.57) | NPC1NTSR1RAB9AKDM4EMAPK1 | |
| SCHEMBL20358566 | 0.74 | NPC1 (0.59) | NPC1NTSR1RAB9AKDM4EMAPK1 | |
| SCHEMBL20358080 | 0.74 | NPC1 (0.57) | NPC1NTSR1RAB9AKDM4EMAPK1 | |
| SCHEMBL28652692 | 0.74 | NPC1 (0.57) | NPC1NTSR1RAB9AKDM4EMAPK1 | |
| SCHEMBL20358292 | 0.74 | NPC1 (0.57) | NPC1NTSR1RAB9AKDM4EMAPK1 | |
| SCHEMBL20357895 | 0.74 | NPC1 (0.57) | NPC1NTSR1RAB9AKDM4EMAPK1 | |
| SCHEMBL20358212 | 0.72 | KIF11 (0.58) | NPC1NTSR1RAB9AKDM4EMAPK1 | |
| SCHEMBL17971504 | 0.72 | NPC1 (0.65) | NPC1NTSR1RAB9AKDM4EMAPK1 | |
| SCHEMBL17971498 | 0.72 | NPC1 (0.65) | NPC1NTSR1RAB9AKDM4EMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105555910-A | Electrochromic two-core viologen derivatives and optical articles containing them | ESSILOR INT CIE GENERALE D'OPTIQUE | 2016-05-04 | — | — | CN | disclosed |