Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | TYK2 | P29597 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11234000 | 1.00 | MAPT (0.53) | MAPTCYP19A1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL11247103 | 0.86 | MAPT (0.54) | MAPTCYP19A1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL11247102 | 0.86 | MAPT (0.54) | MAPTCYP19A1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL11239698 | 0.84 | MAPT (0.50) | MAPTCYP19A1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL11239695 | 0.84 | MAPT (0.50) | MAPTCYP19A1ALDH1A1TSHRCYP1A2 | |
| Hydrochloric Acid SCHEMBL11243888 | 0.83 | MAPT (0.49) | MAPTCYP19A1ALDH1A1TSHRCYP1A2 | |
| Hydrochloric Acid SCHEMBL11243883 | 0.83 | MAPT (0.49) | MAPTCYP19A1ALDH1A1TSHRCYP1A2 | |
| Hydrochloric Acid SCHEMBL10879898 | 0.83 | GABRA1 (0.46) | MAPTALDH1A1TSHRCYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL10879902 | 0.83 | GABRA1 (0.46) | MAPTALDH1A1TSHRCYP1A2CYP3A4 | |
| Oxalic Acid SCHEMBL10505848 | 0.82 | MAPT (0.47) | MAPTCYP19A1ALDH1A1TSHRCYP1A2 |
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 |