Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | CASP1 | P29466 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.51 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.50 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11241833 | 1.00 | RAB9A (0.58) | RAB9ANPC1SMN1; SMN2TSHRCASP1 | |
| SCHEMBL10921919 | 0.83 | RAB9A (0.60) | RAB9ANPC1SMN1; SMN2TSHRCASP1 | |
| SCHEMBL14416834 | 0.83 | MAPT (0.57) | RAB9ANPC1SMN1; SMN2TSHRCASP1 | |
| SCHEMBL10921915 | 0.83 | RAB9A (0.60) | RAB9ANPC1SMN1; SMN2TSHRCASP1 | |
| SCHEMBL28340426 | 0.81 | MAPT (0.56) | RAB9ANPC1SMN1; SMN2TSHRCASP1 | |
| SCHEMBL846890 | 0.81 | HPGD (0.49) | RAB9ANPC1SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL846889 | 0.81 | HPGD (0.49) | RAB9ANPC1SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL10805785 | 0.80 | PTPN5 (0.65) | RAB9ANPC1SMN1; SMN2TSHRCASP1 | |
| SCHEMBL10805789 | 0.80 | PTPN5 (0.65) | RAB9ANPC1SMN1; SMN2TSHRCASP1 | |
| SCHEMBL30513965 | 0.80 | SMN1; SMN2 (0.61) | RAB9ANPC1SMN1; SMN2TSHRCASP1 |
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 |