Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.60 |
| ▸ | AURKA | O14965 | 2/20 | 0.53 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.53 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.53 |
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | GLS | O94925 | 3/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8279661 | 0.80 | POLB (0.53) | BRD4NAMPTALDH1A1MAPTTP53 | |
| SCHEMBL7876727 | 0.77 | BRD4 (0.56) | BRD4AURKARPS6KB1AURKBNAMPT | |
| SCHEMBL31709823 | 0.77 | BRD4 (0.54) | BRD4AURKARPS6KB1NAMPTGLS | |
| SCHEMBL731764 | 0.77 | BRD4 (0.54) | BRD4AURKARPS6KB1NAMPTGLS | |
| SCHEMBL828560 | 0.76 | TP53 (0.51) | MEN1ALDH1A1MAPTKMT2ANPC1 | |
| SCHEMBL7880096 | 0.75 | BRD4 (0.56) | BRD4AURKARPS6KB1NAMPTMEN1 | |
| SCHEMBL3507808 | 0.75 | BRD4 (0.53) | BRD4AURKARPS6KB1NAMPTRAB9A | |
| SCHEMBL29289884 | 0.75 | BRD4 (0.53) | BRD4AURKARPS6KB1NAMPTALDH1A1 | |
| SCHEMBL18630525 | 0.75 | BRD4 (0.53) | BRD4AURKARPS6KB1NAMPTGLS | |
| SCHEMBL7876801 | 0.75 | BRD4 (0.49) | BRD4AURKARPS6KB1NAMPTGLS |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1244542-C | Aromatic amine derivatives having NOS inhibitory effect | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2006-03-08 | — | — | CN | disclosed |
| US-6331553-B1 | INHIBITORS OF NITRIC OXIDE SYNTHASE; TREATING CEREBROVASCULAR DISEASES | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2001-12-18 | — | — | US | disclosed |
| CN-1240419-A | Aromatic amine derivatives having NOS inhibitory effect | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2000-01-05 | — | — | CN | disclosed |
| EP-0949242-A1 | AROMATIC AMINE DERIVATIVES HAVING NOS INHIBITORY EFFECT | Chugai Seiyaku Kabushiki Kaisha (JP) | 1999-10-13 | — | — | EP | disclosed |