Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.42 |
| ▸ | BCAT1 | P54687 | 4/20 | 0.40 |
| ▸ | NMUR2 | Q9GZQ4 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.35 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.35 |
| ▸ | TTR | P02766 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20114278 | 0.82 | ALOX5 (0.41) | NMUR2RAB9ANPC1CSNK2A2CSNK2B | |
| SCHEMBL20114159 | 0.81 | CYP1A2 (0.40) | IDO1BCAT1NMUR2RAB9ANPC1 | |
| SCHEMBL24178070 | 0.80 | BCAT1 (0.48) | IDO1BCAT1RAB9ANPC1TTR | |
| SCHEMBL20114078 | 0.77 | ALDH1A1 (0.40) | RAB9ANPC1HPGDSMN1; SMN2KDM4E | |
| SCHEMBL24344541 | 0.74 | NR1H4 (0.34) | BCAT1RAB9ANPC1HPGDSMN1; SMN2 | |
| SCHEMBL20114136 | 0.74 | ALOX5 (0.39) | NMUR2HPGDKDM4EMEN1ALDH1A1 | |
| SCHEMBL20114162 | 0.74 | PDK2 (0.33) | RAB9ANPC1MEN1MAPTKMT2A | |
| SCHEMBL24285653 | 0.72 | TTR (0.46) | BCAT1RAB9ANPC1TTRMAOA | |
| SCHEMBL24285623 | 0.70 | NPC1 (0.46) | IDO1BCAT1RAB9ANPC1TTR | |
| SCHEMBL19346582 | 0.70 | ALOX5 (0.44) | RAB9ANPC1CSNK2A2CSNK2BMAOA |
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-2018080067-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING SAME | 주식회사 두산 | 2018-05-03 | — | — | WO | disclosed |