Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18915032 | 0.89 | MEN1 (0.38) | NPC1CYP1A2HPGDCYP3A4MAPT | |
| SCHEMBL18915463 | 0.86 | HPRT1 (0.39) | NPC1CYP1A2HPGDCYP3A4MAPT | |
| SCHEMBL18914940 | 0.80 | HPRT1 (0.43) | NPC1CYP1A2HPGDCYP3A4MAPT | |
| SCHEMBL18915040 | 0.74 | TDP1 (0.34) | NPC1MAPTRAB9AHSP90AA1ALDH1A1 | |
| SCHEMBL18915039 | 0.72 | CDK4 (0.38) | NPC1CYP1A2HPGDMAPTRAB9A | |
| SCHEMBL15797015 | 0.71 | CYP1A2 (0.54) | NPC1CYP1A2HPGDCYP3A4MAPT | |
| SCHEMBL305477 | 0.70 | FGFR1 (0.47) | NPC1CYP1A2HPGDCYP3A4MAPT | |
| SCHEMBL19031818 | 0.69 | MAPT (0.40) | NPC1CYP1A2HPGDCYP3A4MAPT | |
| SCHEMBL15797007 | 0.68 | NR3C1 (0.52) | NPC1CYP1A2HPGDCYP3A4MAPT | |
| SCHEMBL19031807 | 0.67 | ALDH1A1 (0.42) | NPC1CYP1A2HPGDCYP3A4MAPT |
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-2017090901-A1 | ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | 주식회사 두산 | 2017-06-01 | — | — | WO | disclosed |