Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | NQO2 | P16083 | 5/20 | 0.43 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL31391352 | 0.81 | EGFR (0.46) | GRM5KCNH2NQO2PDE3BPDE3A | |
| SCHEMBL5213685 | 0.81 | EGFR (0.46) | GRM5KCNH2NQO2PDE3BPDE3A | |
| SCHEMBL25381297 | 0.79 | ALDH1A1 (0.53) | GRM5KCNH2NQO2PDE3BPDE3A | |
| SCHEMBL10613423 | 0.79 | GRM5 (0.44) | GRM5KCNH2NQO2PDE3BPDE3A | |
| SCHEMBL25337729 | 0.79 | SMN1; SMN2 (0.46) | GRM5KCNH2NQO2PDE3BPDE3A | |
| Hydrochloric Acid SCHEMBL28044722 | 0.78 | ALDH1A1 (0.51) | GRM5KCNH2NQO2PDE3BPDE3A | |
| SCHEMBL25381668 | 0.76 | ELANE (0.41) | GRM5KCNH2NQO2PDE3BPDE3A | |
| SCHEMBL28146671 | 0.75 | GRM5 (0.54) | GRM5KCNH2NQO2PDE3BPDE3A | |
| Hydrochloric Acid SCHEMBL28214494 | 0.72 | MCHR1 (0.49) | NQO2PDE3BPDE3APKMPOLB | |
| SCHEMBL26317670 | 0.72 | PDGFRA (0.47) | PDE3BPDE3APKMALDH1A1KDM4E |
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-105051018-A | Heterocyclic substituted 2-amino-quinazoline derivatives for the treatment of viral infections | JANSSEN R&D IRELAND | 2015-11-11 | — | — | CN | disclosed |