Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 7/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | TOP2A | P11388 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18660360 | 0.82 | TOP1 (0.44) | TOP1LMNAAKT1HPGDKDM4E | |
| SCHEMBL2220405 | 0.79 | DHODH (0.41) | TOP1LMNAAKT1NPC1KDM4E | |
| SCHEMBL10948806 | 0.78 | LMNA (0.41) | TOP1LMNA | |
| Hydrochloric Acid SCHEMBL5050003 | 0.76 | LMNA (0.46) | TOP1LMNAAKT1NPC1HPGD | |
| SCHEMBL9637296 | 0.76 | TOP1 (0.35) | TOP1LMNAHPGDTOP2AALDH1A1 | |
| SCHEMBL1076920 | 0.73 | LMNA (0.50) | TOP1LMNANPC1HPGDKDM4E | |
| SCHEMBL6556746 | 0.72 | LMNA (0.49) | TOP1LMNANPC1HPGDKDM4E | |
| Hydrochloric Acid SCHEMBL1571752 | 0.72 | LMNA (0.49) | TOP1LMNANPC1HPGDKDM4E | |
| SCHEMBL9860636 | 0.72 | LMNA (0.49) | TOP1LMNANPC1HPGDKDM4E | |
| SCHEMBL456098 | 0.72 | LMNA (0.49) | TOP1LMNANPC1HPGDKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009083197-A2 | ASYMMETRIC PHENANTHROLINES, PREPARATION PROCESS THEREFORE AND DOPED ORGANIC SEMICONDUCTOR MATERIAL CONTAINING THEM | NOVALED AG (DE) | 2009-07-09 | — | — | WO | disclosed |
| WO-2007110228-A1 | N-HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRONIC, OPTOELECTRONIC AND ELECTROLUMINESCENT COMPONENTS | NOVALED AG (DE) | 2007-10-04 | — | — | WO | disclosed |