Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.73 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.62 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | ESR1 | P03372 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.56 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.56 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.56 |
| ▸ | EGFR | P00533 | 1/20 | 0.56 |
| ▸ | GBA1 | P04062 | 1/20 | 0.56 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.56 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | PRKCG | P05129 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | PRKCB | P05771 | 1/20 | 0.56 |
| ▸ | LCK | P06239 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL1405661 | 0.92 | LTA4H (0.85) | LTA4HKEAP1NFE2L2MAPTCYP2D6 | |
| Ethylamine SCHEMBL9873135 | 0.91 | LSS (0.69) | LTA4HESR1LSSTAAR1HRH3 | |
| Bromide SCHEMBL1174583 | 0.90 | LTA4H (0.81) | LTA4HKEAP1NFE2L2MAPTCYP2D6 | |
| Hydrochloric Acid SCHEMBL10682691 | 0.90 | LTA4H (0.81) | LTA4HKEAP1NFE2L2MAPTCYP2D6 | |
| Ethylamine SCHEMBL9872082 | 0.89 | KDM4E (0.66) | LTA4HMAPTKMT2ALSSTAAR1 | |
| Bromide SCHEMBL8494655 | 0.88 | LTA4H (0.79) | LTA4HKEAP1NFE2L2MAPTCYP2D6 | |
| Bromide SCHEMBL8494658 | 0.88 | LTA4H (0.79) | LTA4HKEAP1NFE2L2MAPTCYP2D6 | |
| Tetradecane SCHEMBL28897526 | 0.85 | LTA4H (0.69) | LTA4HMAPTCYP2D6ESR1MEN1 | |
| Tetradecane SCHEMBL28451741 | 0.84 | LTA4H (0.67) | LTA4HMAPTCYP2D6ESR1MEN1 | |
| Methylamine SCHEMBL27703437 | 0.82 | LSS (0.73) | LTA4HLSSHRH3KDM4EALDH1A1 |
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-5021429-A | Histamine h2-antagonists; antisecretory-antiallergen agent; skin disorders and peptic ulcers | ALLEN & HANSBURYS LIMITED (GB) | 1991-06-04 | — | — | US | disclosed |