Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 2/20 | 0.39 |
| ▸ | IKBKB | O14920 | 3/20 | 0.37 |
| ▸ | GRK6 | P43250 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CDC7 | O00311 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 2/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | YWHAG | P61981 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28682552 | 0.85 | ALDH1A1 (0.37) | NQO2IKBKBALDH1A1MAPTKMT2A | |
| SCHEMBL4382058 | 0.82 | KDM4E (0.43) | ALDH1A1MAPTKMT2AMEN1MAPK1 | |
| SCHEMBL31493862 | 0.77 | KDM4E (0.41) | NQO2IKBKBALDH1A1MAPTKMT2A | |
| SCHEMBL5847055 | 0.75 | IKBKB (0.50) | NQO2IKBKBGRK6BRD4ALDH1A1 | |
| SCHEMBL28578491 | 0.72 | ALDH1A1 (0.44) | ALDH1A1MAPTKMT2AMEN1MAPK1 | |
| SCHEMBL23042699 | 0.71 | NQO2 (0.34) | NQO2IKBKBALDH1A1MAPTKDM4E | |
| SCHEMBL31515128 | 0.68 | NQO2 (0.46) | NQO2IKBKBGRK6ALDH1A1MAPT | |
| SCHEMBL31515130 | 0.68 | NQO2 (0.46) | NQO2IKBKBGRK6ALDH1A1MAPT | |
| SCHEMBL12966232 | 0.68 | HDAC3 (0.41) | NQO2ALDH1A1MAPTKMT2AMEN1 | |
| SCHEMBL29595299 | 0.68 | HDAC3 (0.41) | NQO2ALDH1A1MAPTKMT2AMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0983227-B8 | PREPARATION OF TRI-IODO BENZENE COMPOUNDS | GE HEALTHCARE AS (NO) | 2006-10-25 | — | — | EP | disclosed |
| EP-0983227-A1 | PREPARATION OF TRI-IODO BENZENE COMPOUNDS | NYCOMED IMAGING AS (NO) | 2000-03-08 | — | — | EP | disclosed |
| WO-1998052909-A1 | PREPARATION OF TRI-IODO BENZENE COMPOUNDS | NYCOMED IMAGING AS (NO) | 1998-11-26 | — | — | WO | disclosed |