Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.31 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.31 |
| ▸ | SCN4A | P35499 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | GRM5 | P41594 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7163648 | 0.86 | NISCH (0.39) | NISCHGAATSHRSIGMAR1MEN1 | |
| SCHEMBL25976423 | 0.82 | MEN1 (0.38) | NISCHGAATSHRMEN1KMT2A | |
| SCHEMBL10017294 | 0.79 | CYP2A6 (0.48) | NISCHKDM4EMAPTALDH1A1HPGD | |
| SCHEMBL23018489 | 0.77 | MAOA (0.42) | MEN1KMT2AKDM4EMAPTALDH1A1 | |
| SCHEMBL8458131 | 0.72 | KDM4E (0.46) | NISCHTSHRKDM4ENPC1MAPT | |
| SCHEMBL31038279 | 0.71 | NISCH (0.36) | NISCHGAAMEN1KMT2AHTR2C | |
| SCHEMBL29028946 | 0.67 | ADRA2A (0.47) | SIGMAR1HTR2C | |
| SCHEMBL24365040 | 0.66 | CHRM2 (0.38) | MAPTALDH1A1HPGD | |
| Biphenyl SCHEMBL29276701 | 0.64 | NISCH (0.45) | NISCHGAATSHRMEN1KMT2A | |
| Biphenyl SCHEMBL28051011 | 0.63 | ALDH1A1 (0.56) | NISCHGAATSHRSIGMAR1MEN1 |
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-2012005214-A1 | ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME | JNC株式会社 (JP) | 2012-01-12 | — | — | WO | disclosed |