Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11239695 | 1.00 | MAPT (0.50) | MAPTCYP3A4CYP19A1ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL11243888 | 0.99 | MAPT (0.49) | MAPTCYP3A4CYP19A1ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL11243883 | 0.99 | MAPT (0.49) | MAPTCYP3A4CYP19A1ALDH1A1POLB | |
| SCHEMBL11234000 | 0.84 | MAPT (0.53) | MAPTCYP3A4CYP19A1ALDH1A1MEN1 | |
| SCHEMBL11234002 | 0.84 | MAPT (0.53) | MAPTCYP3A4CYP19A1ALDH1A1MEN1 | |
| SCHEMBL11247102 | 0.83 | MAPT (0.54) | MAPTCYP3A4CYP19A1ALDH1A1TDP1 | |
| SCHEMBL11247103 | 0.83 | MAPT (0.54) | MAPTCYP3A4CYP19A1ALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL10876102 | 0.81 | MAPT (0.42) | MAPTCYP3A4ALDH1A1TDP1LMNA | |
| Hydrochloric Acid SCHEMBL10876112 | 0.81 | MAPT (0.42) | MAPTCYP3A4ALDH1A1TDP1LMNA | |
| SCHEMBL10874271 | 0.79 | MAPT (0.44) | MAPTCYP3A4CYP19A1ALDH1A1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4317831-A | Antimicrobial derivatives of 3-(1H-imidazol-1-yl)-2-propen-1-ones | E. R. SQUIBB & SONS, INC. (US) | 1982-03-02 | — | — | US | disclosed |
| US-4273776-A | Antibacterial and antifungal derivatives of 3-(1H-imidazol-1-yl)-2-propen-1-ones | E. R. SQUIBB & SONS, INC. (US) | 1981-06-16 | — | — | US | disclosed |