Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7695816 | 0.85 | ALDH1A1 (0.43) | ALDH1A1KDM4EADORA2AMAPK1MEN1 | |
| SCHEMBL7692593 | 0.84 | DHFR (0.43) | TDP1ALDH1A1KDM4EADORA2AMAPK1 | |
| SCHEMBL7699374 | 0.81 | ADORA2A (0.47) | ALDH1A1KDM4EADORA2ASMN1; SMN2L3MBTL1 | |
| SCHEMBL7692244 | 0.81 | KDM4E (0.56) | TDP1ALDH1A1KDM4EADORA2ASMN1; SMN2 | |
| SCHEMBL13020034 | 0.79 | TDP1 (0.63) | TDP1ALDH1A1KDM4EADORA2ASMN1; SMN2 | |
| SCHEMBL22969696 | 0.77 | TDP1 (0.58) | TDP1ALDH1A1KDM4EADORA2ASMN1; SMN2 | |
| SCHEMBL31448354 | 0.74 | ALDH1A1 (0.47) | TDP1ALDH1A1KDM4EADORA2ASMN1; SMN2 | |
| SCHEMBL14211976 | 0.74 | TDP1 (0.56) | TDP1ALDH1A1KDM4EADORA2ASMN1; SMN2 | |
| SCHEMBL16659834 | 0.73 | TDP1 (0.79) | TDP1ALDH1A1KDM4EADORA2ASMN1; SMN2 | |
| SCHEMBL16702152 | 0.73 | DHFR (0.47) | TDP1ALDH1A1KDM4EADORA2ASMN1; SMN2 |
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-2002094796-A2 | BENZO[G]QUINOXALINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES | AXXIMA PHARMACEUTICALS AG (DE) | 2002-11-28 | — | — | WO | disclosed |