Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.58 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.58 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.58 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.58 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | FYN | P06241 | 5/20 | 0.56 |
| ▸ | DYRK1A | Q13627 | 6/20 | 0.52 |
| ▸ | DYRK2 | Q92630 | 5/20 | 0.52 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.51 |
| ▸ | CDK2 | P24941 | 4/20 | 0.51 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.51 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL16265156 | 0.92 | KDM4E (0.59) | KDM4EALDH1A1CYP1A2CYP3A4GABRA1 | |
| SCHEMBL10849053 | 0.83 | KDM4E (0.67) | KDM4EALDH1A1CYP1A2CYP3A4GABRA1 | |
| SCHEMBL29920550 | 0.83 | KDM4E (0.67) | KDM4EALDH1A1CYP1A2CYP3A4GABRA1 | |
| SCHEMBL102751 | 0.81 | DYRK1A (0.76) | KDM4EALDH1A1CYP1A2CYP3A4GABRA1 | |
| SCHEMBL11625699 | 0.81 | CYP1A2 (0.68) | KDM4EALDH1A1CYP1A2CYP3A4GABRA1 | |
| SCHEMBL14881900 | 0.77 | FYN (0.57) | KDM4EALDH1A1CYP1A2CYP3A4GABRA1 | |
| SCHEMBL1659484 | 0.76 | MET (0.65) | — | |
| SCHEMBL16331190 | 0.76 | FYN (0.79) | FYNDYRK1ADYRK2CCNA2CDK2 | |
| SCHEMBL14881421 | 0.76 | FYN (0.61) | KDM4EALDH1A1CYP1A2CYP3A4GABRA1 | |
| SCHEMBL11626491 | 0.76 | CYP1A2 (0.71) | KDM4EALDH1A1CYP1A2CYP3A4GABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4569934-A | ANTIANXIETY AGENTS | AMERICAN CYANAMID COMPANY (US) | 1986-02-11 | — | — | US | disclosed |