Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.49 |
| ▸ | CDK9 | P50750 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 5/20 | 0.43 |
| ▸ | APAF1 | O14727 | 1/20 | 0.43 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.42 |
| ▸ | IDE | P14735 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27687439 | 0.92 | BRD4 (0.48) | BRD4CDK9ATMAPAF1TLR9 | |
| SCHEMBL5128033 | 0.81 | BRD4 (0.48) | BRD4CDK9ATMAPAF1TLR9 | |
| SCHEMBL5113401 | 0.81 | BRD4 (0.53) | BRD4CDK9ATMAPAF1TLR9 | |
| SCHEMBL5122857 | 0.79 | BRD4 (0.45) | BRD4CDK9ATMAPAF1TLR9 | |
| SCHEMBL27706739 | 0.78 | BRD4 (0.52) | BRD4CDK9ATMAPAF1TLR9 | |
| SCHEMBL5129311 | 0.76 | PLAU (0.42) | BRD4CDK9ATMAPAF1TLR9 | |
| SCHEMBL27687440 | 0.76 | ALDH1A1 (0.42) | ATMALDH1A1TRIM33NPC1RAB9A | |
| SCHEMBL27687488 | 0.73 | BRD4 (0.49) | BRD4CDK9ATMAPAF1TLR9 | |
| SCHEMBL7980039 | 0.73 | BRD4 (0.67) | BRD4CDK9ATMAPAF1TLR9 | |
| SCHEMBL6642431 | 0.72 | BRD4 (0.56) | BRD4CDK9ATMAPAF1TLR9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101061118-A | Substituted bicyclic imidazo-3-ylamine compounds | GRUENENTHAL GMBH (DE) | 2007-10-24 | — | — | CN | disclosed |